UCSF

ZINC38577572

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 22 No

Popular Name: (8aS)-2-(N'-cyclohexylidenehydrazino)-6,7,8,8a-tetrahydro-5H-benzothiopheno[2,3-d]pyrimidin-4-one (8aS)-2-(N'-cyclohexylidenehydra…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.67 8.57 -61.28 0 5 -1 69 315.422 2 ↓
Mid Mid (pH 6-8) 3.67 8.67 -19.86 1 5 0 67 316.43 2 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.