Analog ID	Similarity score	SMILES	Selection options Mcule | MolPort | All | None
MolPort-038-949-637	1	CCCC1=NCCCC1
MCULE-1430435229	0.94	C1CCC(CCCCCCCCC)=NC1
MolPort-046-156-275	0.94	CCCCCCCCCC1=NCCCC1
MolPort-004-786-576	0.94	CC1=NC(C)(C)CCC1
MolPort-033-355-967	0.90	CC1=NCCCC1
MolPort-001-943-398	0.86	C1CCC2(CC1)CCCN=C2
MolPort-002-530-167	0.83	C[C@]12CC[C@H]3[C@@H](CCC4CCCC[C@]34C)[C@@H]1CC\C2=N/C1CCCCC1
MolPort-027-849-643	0.83	C[C@]12CCC3C(CCC4CCCC[C@]34C)C1CC\C2=N/C1CCCCC1
MCULE-4171230214	0.83	C12(C)CCC3C(CCC4CCCCC34C)C1CCC2=NC1CCCCC1
MCULE-5802235787	0.83	[C@]12(C)CC[C@]3([C@@]([H])(CCC4CCCC[C@]34C)[C@]1([H])CCC2=NC1CCCCC1)[H]
MolPort-028-950-579	0.81	CC1(C)CCCN=C1
MCULE-6796261074	0.79	C12(CC3CC(CC(C3)C1)C2)N=CC(C)C
MolPort-023-307-241	0.79	CC(C)\C=N\C12CC3CC(CC(C3)C1)C2
MolPort-046-588-819	0.77	CCCC\N=C\CCC
MolPort-006-116-474	0.77	CCCCN=CCCC
MCULE-6626031788	0.75	N1CCCC=1C(C)(C)C
MolPort-001-763-165	0.75	CC(C)(C)C1=NCCC1
MolPort-007-996-393	0.73	NC1=NCCCCC1
MCULE-7781415779	0.72	N1CCCCCC=1N
MolPort-046-688-649	0.71	Cl.[13CH3][13C](=O)C1=NCCCC1
MCULE-2757008672	0.71	Cl.N1CCCCCC=1N
MolPort-019-954-594	0.71	Cl.NC1=NCCCCC1
MCULE-7134924638	0.68	O=C1CCCCC1C1CCCCCCCCCCCN=1
MCULE-7951711593	0.68	O=C1CCCCC1C1CCCCCCCN=1
MCULE-9735306041	0.68	NC1CCCCN=1
MCULE-1020722938	0.66	Cl.NC1CCCCN=1
MolPort-004-946-907	0.66	Cl.NC1=NCCCC1
MCULE-9708097028	0.64	C1(/CCCCCCC/1)=N\C(C)(C)C
MolPort-001-767-570	0.63	CC1=NCCC1
MCULE-5009170423	0.62	N1CCCC=1C
MCULE-7361242893	0.62	N1=CCCC1(C)C
MCULE-7901710063	0.62	C1(/CCCCCC/1)=N\C(C)(C)C

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