| MCULE-7640456712 |
0.92 |
COC1=C(OC)C=C2C(NC=CC2=O)=C1
|
|
| MolPort-005-939-212 |
0.92 |
COC1=C(OC)C=C2C(=O)C=CNC2=C1
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|
| MolPort-005-981-218 |
0.88 |
COC1=C(OC)C(O)=C2C(=O)C3=CC=CC=C3N(C)C2=C1
|
|
| MCULE-8892996530 |
0.88 |
C12C(O)=C(OC)C(=CC=1N(C1=CC=CC=C1C2=O)C)OC
|
|
| MolPort-015-116-151 |
0.87 |
COC1=CC(OC)=C2C(=O)C=CNC2=C1
|
|
| MCULE-4098108611 |
0.87 |
COC1=CC2=C(C(C=CN2)=O)C(OC)=C1
|
|
| MCULE-2944011006 |
0.86 |
C1=CC=C2N(C3C=C(OC)C(O)=C(OC)C=3C(=O)C2=C1)C
|
|
| MCULE-1982451125 |
0.86 |
C1C=C2C3C4C(=CC2=CC=1)NC(=O)C=4C(OC)=C(OC)C=3O
|
|
| MCULE-3246875361 |
0.86 |
C1(OC)C(OC)=C2C(=O)NC3C2=C(C2C=CC=CC=2C=3)C=1OC
|
|
| MolPort-039-338-238 |
0.85 |
COC1=C2C(=O)NC3=CC4=C(C=CC=C4)C(=C23)C(OC)=C1OC
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|
| MolPort-006-668-498 |
0.85 |
COC1=C(O)C(OC)=C2C(=O)C3=CC=CC=C3N(C)C2=C1
|
|
| MolPort-005-945-748 |
0.85 |
COC1=C2C(=O)NC3=CC4=C(C=CC=C4)C(=C23)C(O)=C1OC
|
|
| MCULE-9649094183 |
0.81 |
C1(=O)C2=CC=CC=C2NC2C=CC=C(OC)C1=2
|
|
| MolPort-002-845-856 |
0.81 |
COC1=C2C(=O)C3=CC=CC=C3NC2=CC=C1
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|
| MolPort-027-836-856 |
0.79 |
COC1=CC=C2C(=O)C=CNC2=C1
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|
| MolPort-001-740-433 |
0.78 |
COC1=C(OC)C(OC)=C2C(=O)C3=CC=CC=C3N(C)C2=C1OC
|
|
| MCULE-7565164054 |
0.78 |
C12C(OC)=C(OC)C(OC)=C(OC)C=1N(C)C1=CC=CC=C1C2=O
|
|
| MCULE-1592214653 |
0.77 |
C12C(=O)C=CNC=1C=C1OCOC1=C2
|
|
| MolPort-023-282-695 |
0.76 |
COC1=C(OC)C(OC)=C2C=CNC2=C1
|
|
| MolPort-009-199-590 |
0.76 |
COC1=C(OC)C=C2C(O)=CC(=O)NC2=C1
|
|
| MCULE-1628258533 |
0.76 |
C12C=CNC1=CC(=C(OC)C=2OC)OC
|
|
| MCULE-6410568511 |
0.76 |
C1C(OC)=C(OC)C=C2NC(=O)C=C(O)C=12
|
|
| MCULE-8575006714 |
0.76 |
C12C(=O)C=CNC1=CC1OCCOC=1C=2
|
|
| MCULE-4552310688 |
0.76 |
C1(=O)C2=CC=CC=C2NC2C=CC(OC)=CC1=2
|
|
| MolPort-000-924-756 |
0.76 |
COC1=CC=C2NC3=CC=CC=C3C(=O)C2=C1
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| MolPort-008-426-537 |
0.76 |
COC1=CC=C2NC=CC(=O)C2=C1
|
|
| MolPort-020-989-265 |
0.75 |
COC1=C(OC)C=C2C=CC(=O)NC2=C1
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|
| MCULE-9673527901 |
0.75 |
C12C=CC(=O)NC=1C=C(OC)C(OC)=C2
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|
| MolPort-029-117-372 |
0.74 |
COC1=C(OC)C2=CN=CC=C2C=C1
|
|
| MolPort-022-133-317 |
0.74 |
COC1=CC2=CC=CN=C2C=C1OC
|
|
| MCULE-5913721591 |
0.74 |
COC1C=C2C(N=CC=C2)=CC=1OC
|
|
| MCULE-5387067747 |
0.74 |
C12C(=O)C=CN(CC#N)C1=CC(OC)=C(OC)C=2
|
|
| MCULE-1143734644 |
0.74 |
C12=CC(OC)=C(C=C1NC=C(I)C2=O)OC
|
|
| MCULE-7178453480 |
0.74 |
O=C1NC=CC2C=C(OC)C(OC)=CC=21
|
|
| MolPort-001-793-885 |
0.74 |
COC1=C(OC)C=C2C(=O)NC=CC2=C1
|
|
| MolPort-005-934-868 |
0.73 |
COC1=CC2=NC=CC(O)=C2C=C1OC
|
|
| MCULE-3716003908 |
0.73 |
C12C(OC)=CC=C(OC)C=1NC1C(=CC=CC=1)C2=O
|
|
| MCULE-7737662650 |
0.73 |
C12C(=O)C=CN(CCC#N)C1=CC(OC)=C(OC)C=2
|
|
| MolPort-035-705-682 |
0.72 |
COC1=CC2=C(C=C1)C=C1NC(=O)C3=CC(OC)=C(OC)C2=C13
|
|
| MolPort-007-996-531 |
0.72 |
COC1=CC=C2N(C)C=CC(=O)C2=C1
|
|
| MCULE-8768864020 |
0.72 |
C1(OC)C=C2C(=O)NC3C2=C(C2C=C(OC)C=CC=2C=3)C=1OC
|
|
| MCULE-5447252802 |
0.72 |
C12=CC(OC)=CC=C1N(C=CC2=O)C
|
|
| MCULE-6174399879 |
0.72 |
C1C=C2C(=O)C3C(O)=CC(O)=C(OC)C=3N(C)C2=CC=1
|
|
| MolPort-023-278-995 |
0.72 |
COC1=C2N(C)C3=CC=CC=C3C(=O)C2=C(O)C=C1O
|
|
| MolPort-029-216-891 |
0.71 |
COC1=CC=C2NC=CC2=C1OC
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|
| MolPort-000-154-624 |
0.71 |
COC1=C(OC)C=C2C=CNC2=C1
|
|
| MolPort-000-928-925 |
0.71 |
COC1=CC(OC)=C2C=CNC2=C1
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|
| MolPort-028-750-169 |
0.71 |
O=C1C=CNC2=CC3=C(OCCOCCOCCO3)C=C12
|
|
| MolPort-015-116-142 |
0.71 |
O=C1C=CNC2=CC=C(OC3=CC=CC=C3)C=C12
|
|
| MCULE-8141668993 |
0.71 |
C1(OC)C=C2C(=O)NC3C2=C(C2C=CC=CC=2C=3)C=1OC
|
|
| MCULE-8707429860 |
0.71 |
C12NC=CC1=C(OC)C=C(OC)C=2
|
|
| MCULE-9203212898 |
0.71 |
C12NC=CC=1C=C(OC)C(OC)=C2
|
|
| MCULE-1180165899 |
0.71 |
N1C2=C(C=C3OCCOCCOCCOC3=C2)C(=O)C=C1
|
|
| MCULE-7869562561 |
0.71 |
N1C2=C(C(OC)=CC=C2Br)C(=O)C=C1
|
|
| MCULE-2853137794 |
0.71 |
O=C1C2=C(C=CC(=C2)OC2=CC=CC=C2)NC=C1
|
|
| MolPort-035-705-678 |
0.71 |
COC1=C(OC)C2=C3C(NC(=O)C3=C1)=CC1=C2C=CC=C1
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|
| MolPort-002-539-434 |
0.70 |
CCOC1=CC=C2NC3=CC(N)=CC=C3C(=O)C2=C1
|
|
| MCULE-4367115810 |
0.70 |
C12=CC(OC)=C(C=C1C(=O)C=CN2CC(N)=O)OC
|
|
| MCULE-6565875313 |
0.70 |
C12C(=O)C=CN(CCC(N)=O)C1=CC(OC)=C(OC)C=2
|
|
| MCULE-2067977767 |
0.70 |
O=C1C2C(=C(C(=CC=2N=CN1)OC)OC)OC
|
|
| MCULE-1071458170 |
0.70 |
C12NC(=O)C=C(O)C=1C=C(OC)C(OC)=C2OC
|
|
| MCULE-6874969993 |
0.70 |
C12C=C(OC)C=CC=1N(C=CC2=O)CC
|
|
| MCULE-6828609689 |
0.70 |
C1NC2C(=C(OC)C(O)=CC=2)C=1
|
|
| MCULE-4019596365 |
0.70 |
C1=CC=C2C=C3C4C(C2=C1)=C(O)C(OC)=CC=4C(=O)N3
|
|
| MCULE-8104459228 |
0.70 |
N1C2=C(C=CC(OC)=C2)C(O)=CC1=O
|
|
| MCULE-1255852509 |
0.70 |
C1(O)C=C2C(=O)NC3C2=C(C2C=C(O)C=CC=2C=3)C=1OC
|
|
| MCULE-3072100648 |
0.70 |
C12=CC(OC)=C(C=C1C(=O)C=CN2CC(O)=O)OC
|
|
| MolPort-002-043-112 |
0.70 |
COC1=CC=C2C(O)=CC(=O)NC2=C1
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|
| MolPort-005-945-747 |
0.70 |
COC1=C(O)C2=C3C(NC(=O)C3=C1)=CC1=C2C=CC=C1
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|
| MolPort-035-705-671 |
0.70 |
COC1=C(O)C=C2C(=O)NC3=CC4=C(C=C(O)C=C4)C1=C23
|
|
| MolPort-020-989-401 |
0.69 |
COC1=CC2=CC=C(N)N=C2C=C1OC
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|
| MCULE-7780745920 |
0.69 |
C12C(O)=CC(=CC=1N(C1=CC=CC=C1C2=O)C)O
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|
| MCULE-5006088733 |
0.69 |
O=C1C2C=C(C(=CC=2NC=C1)OCC1C=CC=CC=1)OC
|
|
| MCULE-6190914345 |
0.69 |
C12C(=O)C=CN(CCC(O)=O)C1=CC(OC)=C(OC)C=2
|
|
| MCULE-7116148622 |
0.69 |
NC1C2C(=CC(=C(C=2)OC)OC)N=CC=1
|
|
| MCULE-4254235238 |
0.69 |
C1(OC)=C2NC=CC2=CC(OC)=C1OC
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|
| MolPort-023-332-873 |
0.69 |
COC1=C(N)C=CC(OC2=CC=NC3=CC(OC)=C(OC)C=C23)=C1
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|
| MolPort-001-782-348 |
0.69 |
COC1=C(OC)C(OC)=C2NC=CC2=C1
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|
| MolPort-002-535-097 |
0.68 |
COC1=C(OC)C2=C(C=C1)C1=NC=CC3=C1N(C1=C3C=C(O)C=C1)C2=O
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|
| MolPort-002-536-008 |
0.68 |
COC1=CC2=C(C=C1)N1C3=C2C=CN=C3C2=C(C1=O)C(OC)=C(OC)C=C2
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|
| MolPort-002-528-259 |
0.68 |
COC1=C(OC)C2=C(C=C1)C1=NC=CC3=C1N(C1=C3C=CC=C1)C2=O
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|
| MolPort-022-369-707 |
0.68 |
COC1=C(O)C=C2C=CNC2=C1
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|
| MolPort-006-828-272 |
0.68 |
COC1=CC=C2NC=C3C2=C1C(=O)C1=C3C=CC=C1
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|
| MolPort-020-247-476 |
0.68 |
COC1=CC2=NC=CC(OC3=CC=C(N)C=C3)=C2C=C1OC
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|
| MolPort-003-986-706 |
0.68 |
COC1=CC(=O)NC2=CC=CC=C12
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|
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0.68 |
COC1=C2C=CC(=O)NC2=CC=C1
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|
| MolPort-027-837-782 |
0.68 |
COC1=CC=CC2=CC(=O)NC=C12
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|
| MolPort-039-141-798 |
0.68 |
COC1=C(O)C=C2C(=O)NC3=CC4=C(C=CC=C4)C1=C23
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|
| MCULE-9255380797 |
0.68 |
C12NNC(=O)C=1C=NC1=CC(OC)=C(OC)C=C21
|
|
| MCULE-6474160872 |
0.68 |
C1(N)C(=O)NC2=C(C=C(C(OC)=C2)OC)C=1O
|
|
| MCULE-2700385011 |
0.68 |
N12C3=CC=CC=C3C3C=CN=C(C1=3)C1=C(C(OC)=C(C=C1)OC)C2=O
|
|
| MCULE-7468461853 |
0.68 |
N12C3=CC=C(C=C3C3C=CN=C(C1=3)C1=C(C(OC)=C(C=C1)OC)C2=O)OC
|
|
| MCULE-6675738553 |
0.68 |
N12C3=CC=C(C=C3C3C=CN=C(C1=3)C1=C(C(OC)=C(C=C1)OC)C2=O)O
|
|
| MCULE-6740455692 |
0.68 |
C1(OC)C2C(=O)C3C=CC=CC=3C3=CNC(C3=2)=CC=1
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|
| MCULE-1880082993 |
0.68 |
C12C(OC)=CC=CC1=CC(=O)NC=2
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|
| MCULE-5783939937 |
0.68 |
C12C(=CC=NC1=CC(OC)=C(OC)C=2)OC1=CC=C(C=C1)N
|
|
| MCULE-7924902221 |
0.68 |
O=C1C=CC2C(=CC=CC=2N1)OC
|
|
| MCULE-6511307846 |
0.68 |
C1(O)C=C2C(=O)NC3C2=C(C2C=CC=CC=2C=3)C=1OC
|
|
| MCULE-2626309977 |
0.68 |
COC1C2C(=CC=CC=2)NC(=O)C=1
|
|
| MCULE-3885643046 |
0.68 |
COC1C=CC=C2C=1C(=CC=N2)O
|
|
| MCULE-1859519875 |
0.68 |
COC1C=C2C=C(N)C=NC2=CC=1OC
|
|
| MolPort-009-197-583 |
0.68 |
COC1=C2C(O)=CC=NC2=CC=C1
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|
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0.68 |
OC1=C2C(NC3=CC=CC=C3C2=O)=CC=C1
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|
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0.68 |
OC1=CC=C2C(=O)C=CNC2=C1
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|
| MolPort-008-565-736 |
0.68 |
COC1=CC2=CC(N)=CN=C2C=C1OC
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|
| MolPort-002-535-094 |
0.67 |
COC1=CC2=C(C=C1)C1=C3N2C(=O)C2=C(C=CC(OC)=C2OC)C3=NC=C1
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|
| MolPort-019-737-318 |
0.67 |
COC1=CC=C(OC)C2=CN=CC=C12
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|
| MolPort-046-592-220 |
0.67 |
COC1=C2C(O)=CC(=O)N(C)C2=CC=C1
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|
| MolPort-004-340-780 |
0.67 |
COC1=C(OC)C=C2C(NC=C(C#N)C2=O)=C1
|
|
| MCULE-4359873754 |
0.67 |
N12C3=CC(OC)=CC=C3C3C=CN=C(C1=3)C1=C(C(OC)=C(C=C1)OC)C2=O
|
|
| MCULE-9793179089 |
0.67 |
C12C=CN=CC=1C(OC)=CC=C2OC
|
|
| MCULE-2923656548 |
0.67 |
Cl.Cl.NC1C=CC(OC2=CC=NC3C2=CC(OC)=C(OC)C=3)=CC=1
|
|
| MCULE-8625535273 |
0.67 |
N1(C)C2=C(C(OC)=CC=C2)C(O)=CC1=O
|
|
| MCULE-4136664345 |
0.67 |
N1(C(C)C(O)=O)C=CC(C2=CC(OC)=C(OC)C=C12)=O
|
|
| MCULE-5196505658 |
0.67 |
C12=CC(OC)=C(C=C1NC=C(C#N)C2=O)OC
|
|
| MCULE-5110156768 |
0.67 |
N1C(=O)C=CC2C=CC(OC)=CC1=2
|
|
| MCULE-8061948048 |
0.67 |
O(C)C1=CC=C2C(C=CN2)=C1O
|
|
| MCULE-7354482957 |
0.67 |
C1(OC)C=C2C(=O)C(=O)NC3C2=C(C2C=CC=CC=2C=3)C=1OC
|
|
| MCULE-7173256825 |
0.67 |
C12=CC3OCOC=3C=C1NC=C(Br)C2=O
|
|
| MCULE-6459185191 |
0.67 |
C12C(=CC=CC=1NC=C2)OC
|
|
| MCULE-9277324331 |
0.67 |
C12C(=O)C=CN(CCC(NN)=O)C1=CC(OC)=C(OC)C=2
|
|
| MolPort-005-933-155 |
0.67 |
COC1=CC=C2C=CC(=O)NC2=C1
|
|
| MolPort-027-946-344 |
0.67 |
COC1=CC=C2NC=CC2=C1O
|
|
| MolPort-000-139-468 |
0.67 |
COC1=C2C=CNC2=CC=C1
|
|
| MolPort-035-705-677 |
0.67 |
COC1=C(OC)C2=C3C(NC(=O)C(=O)C3=C1)=CC1=C2C=CC=C1
|
|
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0.66 |
COC1=CC=C2NC(=O)C=C(O)C2=C1
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|
| MolPort-046-701-700 |
0.66 |
COC1=CC=C2C(NC(=O)C=C2OC2=CC=CC=C2)=C1
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|
| MolPort-002-842-487 |
0.66 |
COC1=NC2=CC(OC)=C(OC)C=C2C(OC)=C1
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|
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0.66 |
COC1=CC=C2C=CNC(=O)C2=C1
|
|
| MolPort-003-723-834 |
0.66 |
COC1=C2C=CNC(=O)C2=CC=C1
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|
| MolPort-001-757-475 |
0.66 |
COC1=CC2=CC=NC=C2C=C1OC
|
|
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0.66 |
COC1=CC=C2C(O)=CC=NC2=C1
|
|
| MolPort-022-120-012 |
0.66 |
COC1=CC2=CN=CC=C2C(OC)=C1
|
|
| MCULE-6788883184 |
0.66 |
C12C(=O)C=CN(CCC(N)=O)C1=CC(OCC)=C(OCC)C=2
|
|
| MCULE-8127669211 |
0.66 |
C12=CC(OC)=C(C=C1C(=O)C=CN2CC(OC)=O)OC
|
|
| MCULE-8875201038 |
0.66 |
C12=CC(OCC)=C(C=C1C(=O)C=CN2CC(O)=O)OCC
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|
| MCULE-2400732695 |
0.66 |
C12C=C(OC)C(=CC=1C(=CC(OC)=N2)OC)OC
|
|
| MCULE-2443809687 |
0.66 |
C1(C=C2C(N=CC=C2O)=CC=1OCC)OCC
|
|
| MCULE-5009949529 |
0.66 |
C1(=O)NC=CC2C(=CC=CC1=2)OC
|
|
| MCULE-7795879862 |
0.66 |
COC1=CC2=C(C=CNC2=O)C=C1
|
|
| MCULE-6882343029 |
0.66 |
N1C=CC2C=C(OC)C(OC)=CC=2C=1
|
|
| MCULE-8168579104 |
0.66 |
C1C=C2C(N=CC=C2O)=CC=1OC
|
|
| MCULE-4752602091 |
0.66 |
C1=CC2C3C=CC4C=C5OCOC5=CC=4C=3N(C)C(=O)C=2C(OC)=C1OC
|
|
| MCULE-4905329317 |
0.66 |
C12C(=O)C=CN(CCC(OC)=O)C1=CC(OC)=C(OC)C=2
|
|
| MCULE-3368661793 |
0.66 |
C12C(=O)C=CN(CCC(O)=O)C1=CC(OCC)=C(OCC)C=2
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|
| MolPort-039-338-210 |
0.66 |
COC1=C(OC)C2=C(C=C1)C1=C(N(C)C2=O)C2=C(C=C1)C=C1OCOC1=C2
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|
| MolPort-033-439-925 |
0.66 |
COC1=CC=C2NC=C(Br)C(=O)C2=C1
|
|
| MolPort-003-657-217 |
0.65 |
COC1=CC=C2NC3=CC(Cl)=CC=C3C(=O)C2=C1
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|
| MolPort-022-907-087 |
0.65 |
COC1=CC=C(OC)C2=C(O)N=CC=C12
|
|
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0.65 |
CCOC1=CC2=C(C=C1)N1C3=C2C=CN=C3C2=C(C1=O)C(OC)=C(OC)C=C2
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COC1=C2NC(=O)C(OC)=C(OC)C2=CC=C1
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C12C=CC(OC)=CC=1NC(C)=CC2=O.C12C(OC)=CC=CC=1NC(C)=CC2=O
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C12C=NC=CC1=CC1OCOC=1C=2OC
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C12C(=CC=NC1=CC(OC)=C(OC)C=2)OC1C=CC=C(N)C=1
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C1(=O)C2C=CC(=CC=2NC2C=CC(OC)=CC1=2)Cl
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COC1C=C2C(N(C=C2)C)=CC=1OC
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N12C3=CC=C(C=C3C3C=CN=C(C1=3)C1=C(C(OC)=C(C=C1)OC)C2=O)OCC
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C12C=CC=C(OC)C=1NC(C(OC)=C2OC)=O
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C12C(=CC=CC=1N(C)C1=C(C=CC=C1)C2=O)O
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C1(=O)C2=CC=C(C(OC)=C2C=CN1CC1CC1)OC
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C12=C(C=CC=N1)C=CC(OC)=C2
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COC1=CC=C2NC(=O)C=C(OC(C)C)C2=C1
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C1(OC)=CC=C2C(=C1)C(=O)C=CN2CC#N
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C12C=NC=CC1=CC1OCOC=1C=2OC.Br
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C12=C(OC)C=C(C=C1NC(=O)C(Br)=C2)OC
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C1(OC(C)C)C2C=C(OC)C=CC=2NC(=O)C=1
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C12=CC(OC)=C(C=C1C(=O)C=CN2CC(OCC)=O)OC
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C1=CC2C3C=CC4C=C5OCOC5=CC=4C=3N=CC=2C(OC)=C1OC
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C1=CC=C2C(=O)C3C=C(OC)C=CC=3NC(C2=C1)=O
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N1C2C(=CC(OC)=C(OC)C=2)C=C(Br)C=1
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N1C2C=CC=CC=2C(C2C=CC=C(OC)C=21)=O
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C1C=C2C(NC=CC2=O)=C(C=1)OC
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C12C(=CC=C(OC)C=1OC)N=CNC2=O
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C1(OC)C=C2C(=O)C(=O)N(C)C3C2=C(C2C=CC=CC=2C=3)C=1OC
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0.64 |
C12=C(OC)C(OC)=CC=C1C(=CC(=O)N2)O
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C1(O)=C(OC)C=CC2=CC=CN=C12
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C12=CC(OC)=CC=C1N(C=CC2=O)CCC#N
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COC1=CC2=CC(Br)=CN=C2C=C1OC
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COC1=C2NC3=CC=CC=C3C(=O)C2=CC=C1
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COC1=C(OC)C2=C3C(=CC4=C2C=CC=C4)N(C)C(=O)C(=O)C3=C1
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COC1=C2NC=CC(=O)C2=CC=C1
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COC1=CC=C2N(CCC#N)C=CC(=O)C2=C1
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CN1C(=O)C2=C(C=CC3=C2OCO3)C2=C1C1=C(C=C2)C=C2OCOC2=C1
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COC1=CC(=O)N(C)C2=CC=CC=C12
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COC1=CC2=NC=CC(Cl)=C2C=C1OC
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Cl.N1C2C(=CC=C(OC)C=2)C=CC=1
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N1(C(C)C(OC)=O)C=CC(C2=CC(OC)=C(OC)C=C12)=O
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C12C=C(Cl)C(=CC=1NC(=O)C=C2O)OC
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C12C(=CC=NC1=CC(OC)=CC=2OC)N
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N1C2=CC=C(C=C2C=CC1=O)OC
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C1C=C2C3C=CC4C=C5OCOC5=CC=4C=3N(C)C(=O)C2=C2OCOC=12
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C1C=C2C(OC)=CC(=O)N(C)C2=CC=1
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C12C(=O)C=CN(CCC(NN)=O)C1=CC(OCC)=C(OCC)C=2
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COC1C(OC)=CC2C(=NC=CC=2Cl)C=1
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N1C2C(=CC=CC=2)C(OC)=CC=1
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C1(O)C=C2C=NC=CC2=CC=1OC
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N1=C2C=CC=CC2=C(C2C=CC=CC=21)OC
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C1(OC)C(=O)NC2C(=CC=CC=2)C=1O
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N1C2=C(C=C(Cl)C=C2)C(OC)=CC1=O
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N1C2C(=C(C=CC=2)OC2C=CC=CC=2)C=C1
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[N+]1(C)C=CC2C(=CC(=C(OC)C=2)OC)C=1
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C1(=O)N(CC)C=CC2C=CC(OC)=CC1=2
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C1C(=O)NC2=C(C=CC=C2)C=1OCC
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C1C(=O)NC2=C(C=C(C=C2)OCC)C=1O
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COC1=C(OC)C=C2C(NC(C=C2C)=O)=C1
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C1(OC)C=C2C3C=CN=C4C=CC(=O)N(C=34)C2=CC=1OC
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C12C(=O)C=CN(CCC(OC)=O)C1=CC(OCC)=C(OCC)C=2
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COC1=CC=CC2=C1C=C1NC(=O)C3=CC4=C(OCO4)C2=C13
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C1=CC2C3C=CC4C=C5OCOC5=CC=4C=3N=CC=2C(OC)=C1O
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C12=CC(OC)=CC(OC)=C1NC(=O)C=C2O
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C12=C(OC)C=CC(OC)=C1NC(C=C2O)=O
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C12C(O)=CC=NC1=CC=C(OC)C=2
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C1(OC)C(OC)=CC=C2C=CC=NC=12
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NC1=CC2=C(C(OC)=C1)C=CN2
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N12C3=CC=C(C=C3C3C=CN=C(C1=3)C1=C(C(OC)=C(C=C1)OC)C2=O)OCCC
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N1C2C(=CC(OC)=C(OC)C=2)C(Br)=CC=1
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N1=C(Cl)C=CC2=CC(=C(OC)C=C12)OC
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O=C1C2C=C(C(=C(OC)C=2N=CN1)OC)OC
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COC1=CC2=C(C(C(=CN2)C#N)=O)C(OC)=C1
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C1(=O)C2=CC=C(C=C2NC2C=CC(OCC)=CC1=2)N(=O)=O
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C12OCOC=1C1C3C=CC=C(OC)C=3C=C3NC(=O)C(=C2)C=13
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C12=CC(OC)=C(C=C1NC(=C(I)C2=O)C)OC
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COC1C=C2NC3C=C(OC)C=CC=3C2=CC=1
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COC1=CC=C2C(NC3=C2C=CC=C3)=C1
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C12C(=CC=C(OC)C=1)C=CN2
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C1(OC(C)C)C2C=CC=CC=2NC(=O)C=1
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C12C(=CC=NC1=CC(OCC)=C(OCC)C=2)OC1C=CC(=CC=1)N
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C1(=O)C2C=C(OCC)C=CC=2NC2N=CC=CC1=2
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O(CC)C1=CC=C2C(C=CN2)=C1O
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[I-].[N+]1(C)C=CC2C(=CC(=C(OC)C=2)OC)C=1
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N12C=CC=CC1=CC1C(=CC=C(OC)C=1)C2=O
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CCOC1=C2C(NC=C2)=CC=C1
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C1(=O)NC=CC2=CC(OC)=CC=C12
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C12N=CC=C(OC)C1=CC=C1C(=CC=NC=21)OC
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C12=CC(OC)=CC=C1C(C=CN2CCC(N)=O)=O
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COC1=CC2=C(C(=CC=N2)Cl)C(OC)=C1
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C1C=C2C3C=CC4C=C5OCOC5=CC=4C=3N=CC2=C2OCOC=12
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N12C3=CC=C(C=C3C3C=CN=C(C1=3)C1=C(C(OC)=C(C=C1)OC)C2=O)F
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C1C=C2C(=CC=1)N(C)C=C(OC)C2=O
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COC1=CC=C2C=CNC2=C1
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COC1=CC2=C(C=C1)C1=C(N2)C=C(OC)C=C1
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CCOC1=CC=C2NC3=NC=CC=C3C(=O)C2=C1
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COC1=CC=NC2=C1C=CC1=C2N=CC=C1OC
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CCOC1=C2C=CNC2=CC=C1
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COC1=C2C=C(O)C=NC2=CC=C1
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COC1=CC=C2C(=O)NC=CC2=C1
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C1OC2=CC3=C(C=C2O1)C1=C(C=C3)C2=C(C=N1)C1=C(OCO1)C=C2
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COC1=CN(C)C2=CC=CC=C2C1=O
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COC1=C(OC)C2=C(C=C1)C1=NC=CC3=C1N(C1=C3C=C(F)C=C1)C2=O
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0.61 |
COC1=CC=C2C(=O)N(CCCCO)C=CC2=C1OC
|
|
| MolPort-046-154-360 |
0.61 |
COC1=C2C=CN(CC(C)C)C(=O)C2=CC=C1
|
|
| MCULE-6519813487 |
0.61 |
C1(=O)N(CCCO)C=CC2=C(C(OC)=CC=C12)OC
|
|
| MCULE-5448770984 |
0.61 |
C1(=O)N(CCCCO)C=CC2=C(C(OC)=CC=C12)OC
|
|
| MCULE-9012806946 |
0.61 |
[H]Cl.NC1=CC2=C(C(OC)=C1)C=CN2
|
|
| MCULE-7039210597 |
0.61 |
C12C(=S)C=CNC1=CC(OC)=C(OC)C=2
|
|
| MCULE-6503309581 |
0.61 |
C12=CC(OC)=C(C=C1C(=O)C=CN2CC1=NNN=N1)OC
|
|
| MCULE-3719430777 |
0.61 |
C12=CC(OC)=CC=C1N(C=CC2=O)CCC(N)=O
|
|
| MCULE-9174337901 |
0.61 |
C12=CC=C(C=C1N=CC=C2OC1C=CC(=CC=1)N)OC
|
|
| MCULE-2292226033 |
0.61 |
N1(C2C=CC=CC=2)C(=O)C2C=C(C3C(N(C4C=CC=CC=4)C(=O)C4=CC(OC5C=CC=CC=5)=C(C=2C=34)C1=O)=O)OC1C=CC=CC=1
|
|
| MCULE-9827398040 |
0.61 |
COC1=C2C(C(N(C=C2)CC(C)C)=O)=CC=C1
|
|
| MCULE-7733842835 |
0.61 |
N(=O)(=O)C1=CC=C(C=C1)OC1=CC=NC2=CC(OC)=C(OC)C=C12
|
|
| MCULE-3263772536 |
0.61 |
C1C(=O)NC2=C(C=C(C=C2)OC)C=1OCCC
|
|
| MCULE-8355196972 |
0.61 |
N1(CC(O)=O)C=CC(C2=CC=C(OC)C=C12)=O
|
|
| MCULE-1223308660 |
0.61 |
C12C(=CC=CC=1N(C=C2)C)OC
|
|
| MCULE-3000218211 |
0.61 |
C12C3=CC=CC=C3C3C(=CC=CC=3)C1=NC1=CC=C(OC)C=C1N=2
|
|
| MCULE-9109137429 |
0.61 |
N12C3=CC=C(C=C3C3C=CN=C(C1=3)C1=C(C(OC)=C(C=C1)OC)C2=O)OCC=C
|
|
| MCULE-5271684819 |
0.61 |
N12C3=CC=C(C=C3C3C=CN=C(C1=3)C1=C(C(OC)=C(C=C1)OC)C2=O)OC(C)=O
|
|
| MCULE-5785260048 |
0.61 |
C12=CC(OC)=CC=C1N=CC=C2OC1C=CC(=CC=1)N
|
|
| MCULE-3566734844 |
0.61 |
C12C(O)=C(Br)C=NC1=CC(OC)=CC=2OC
|
|
| MCULE-9955834066 |
0.61 |
COC1C=CC2N(C(C=CC=2C=1)=O)C
|
|
| MCULE-7728254425 |
0.61 |
N1C2=C(C=C(Br)C(OC)=C2)C(O)=CC1=O
|
|
| MCULE-7785018700 |
0.61 |
C1(=O)N(CCCF)C=CC2=C(C(OC)=CC=C12)OC
|
|
| MCULE-1970447284 |
0.61 |
C1(=O)N(CCCCF)C=CC2=C(C(OC)=CC=C12)OC
|
|
| MCULE-3444308674 |
0.61 |
C12C(=CC=NC1=CC(OC)=CC=2)N
|
|
| MCULE-8770466161 |
0.61 |
N1C2=CC(OC)=C(N)C=C2C=CC=1
|
|
| MCULE-1384565904 |
0.61 |
C12=CC=CN=C1C(=CC=C2OC)N
|
|
| MCULE-4008303821 |
0.61 |
COC1=C2C(C=NC=C2)=C(N)C=C1
|
|
| MCULE-7972533194 |
0.61 |
C12C(O)=CC=NC1=C(C=C(OC)C=2)OC
|
|
| MCULE-5435310360 |
0.61 |
C12=C(C=CC=C1C(C=CN2C)=O)OC
|
|
| MolPort-016-729-729 |
0.61 |
COC1=CC=C2C(=O)C=CN(CC(O)=O)C2=C1
|
|
| MolPort-001-014-343 |
0.61 |
COC1=CC2=NC3=C(N=C2C=C1)C1=C(C=CC=C1)C1=C3C=CC=C1
|
|
| MolPort-046-649-456 |
0.61 |
COC1=CC=CC2=C1C1=C(C=CC=C1)N2C
|
|
| MolPort-002-535-162 |
0.61 |
COC1=C(OC)C2=C(C=C1)C1=NC=CC3=C1N(C1=C3C=C(OC(C)=O)C=C1)C2=O
|
|
| MolPort-039-347-389 |
0.61 |
COC1=C(OC)C2=C(C=C1)C1=NC=CC3=C1N(C1=C3C=C(OCC=C)C=C1)C2=O
|
|
| MolPort-000-928-856 |
0.61 |
COC1=C2C=CN(C)C2=CC=C1
|
|
| MolPort-028-579-238 |
0.61 |
COC1=CC=C2C(=O)N(CCCF)C=CC2=C1OC
|
|
| MolPort-028-585-851 |
0.61 |
COC1=CC=C2C(=O)N(CCCCF)C=CC2=C1OC
|
|
| MolPort-044-562-126 |
0.61 |
COC1=C(N)C=C2C=CC=NC2=C1
|
|
| MolPort-000-165-138 |
0.61 |
COC1=CC=C(N)C2=NC=CC=C12
|
|
| MolPort-006-170-914 |
0.61 |
COC1=CC2=NC=CC(N)=C2C=C1
|
|
| MolPort-012-655-932 |
0.61 |
COC1=CC=C(N)C2=CN=CC=C12
|
|
| MolPort-007-996-530 |
0.61 |
COC1=C2N(C)C=CC(=O)C2=CC=C1
|
|
| MolPort-019-825-851 |
0.60 |
COC1=CC=C2N(CC(O)=O)C=CC(=O)C2=C1
|
|
| MolPort-004-795-581 |
0.60 |
COC1=C(OC)C=C2C(O)=CC(C)=NC2=C1
|
|
| MolPort-016-731-390 |
0.60 |
COC1=CC=C2C(=O)C=CN(CCC(O)=O)C2=C1
|
|
| MolPort-028-582-092 |
0.60 |
COC1=CC=C2C(=O)N(CCCC(F)(F)F)C=CC2=C1OC
|
|
| MolPort-020-989-306 |
0.60 |
COC1=CC2=NC(Cl)=CC=C2C(OC)=C1
|
|
| MolPort-012-003-226 |
0.60 |
COC1=CC(OC)=C2NC(C)=CC(=O)C2=C1
|
|
| MolPort-023-313-645 |
0.60 |
Cl.COC1=CC=C2NC(=O)C=C(N)C2=C1
|
|
| MolPort-001-837-922 |
0.60 |
CCN1C(=O)C=CC2=CC(OC)=CC=C12
|
|
| MolPort-006-728-065 |
0.60 |
COC1=CC(OC)=C2C(=O)NC=NC2=C1
|
|
| MolPort-009-197-455 |
0.60 |
COC1=CC=C2N=C(O)C=C(O)C2=C1
|
|
| MCULE-4731211304 |
0.60 |
C12C=[N+](C)C=CC1=CC1OCOC=1C=2OC
|
|
| MCULE-1391693567 |
0.60 |
N1(CC(O)=O)C=CC(C2=CC(OC)=CC=C21)=O
|
|
| MCULE-9928112982 |
0.60 |
C12=C(O)C=CN=C1C(=CC=C2OC)Cl
|
|
| MCULE-9598251353 |
0.60 |
C12=CC(OC)=C(C=C1C(=CC(C)=N2)O)OC
|
|
| MCULE-6100293213 |
0.60 |
C12=CC(OC)=CC=C1C(C=CN2CCC(O)=O)=O
|
|
| MCULE-1658346746 |
0.60 |
C12C=C(F)C(=CC=1NC(=O)C=C2O)OC
|
|
| MCULE-6187960196 |
0.60 |
C1(=O)N(CCCC(F)(F)F)C=CC2=C(C(OC)=CC=C12)OC
|
|
| MCULE-7395969137 |
0.60 |
O=C1C2C(=CC(=CC=2N=CN1)OC)OC
|
|
| MCULE-7500740911 |
0.60 |
COC1C2NC=CC=2C=CC=1OC
|
|
| MCULE-8372749784 |
0.60 |
C1C(=O)NC2=C(C=CC(OC)=C2)C=1Cl
|
|
| MCULE-1538407704 |
0.60 |
N1(CC)C(=O)C=CC2C=C(OC)C=CC1=2
|
|
| MCULE-4879993213 |
0.60 |
COC(C1CCCC1)CN1C2C=C(OC)C=C(OC)C=2C(=O)C=C1
|
|
| MCULE-8544129434 |
0.60 |
C12C=[N+](C)C=CC1=CC(OC)=C1OCOC1=2
|
|
| MCULE-7110756423 |
0.60 |
C12=CC(OC)=CC=C1N(C=CC2=O)CCC(O)=O
|
|
| MCULE-3495525187 |
0.60 |
C12C=[N+](C)C=CC1=CC1OCOC=1C=2OC.[Br-]
|
|
| MCULE-3225573457 |
0.60 |
C12=CC=C(C=C1N=CC(Br)=C2O)OC
|
|
| MCULE-7698107235 |
0.60 |
C12=C(C=CC=C1N=C(C=C2OC)OC)OC
|
|
| MCULE-9065472378 |
0.60 |
N1=CC(N)=CC2C=CC(OC)=CC1=2
|
|
| MCULE-4318623716 |
0.60 |
N1C=CC=C2C=C(OC)C=CC2=1
|
|
| MCULE-3426872242 |
0.60 |
COC1=CC2=C(C=CN=C2)C=C1
|
|
| MCULE-5649533868 |
0.60 |
C12C=CN=CC1=CC=CC=2OC
|
|
| MCULE-6024063870 |
0.60 |
N12C3=CC=C(C=C3C3C=CN=C(C1=3)C1=C(C(OC)=C(C=C1)OC)C2=O)OCCCC
|
|
