UCSF

ZINC54689617

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2010 19 No

Popular Name: 2-[[(1S,3S)-3-methylcyclohexyl]sulfanylmethyl]-3H-benzimidazol-5-amine 2-[[(1S,3S)-3-methylcyclohexyl]s…

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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) 2.99 6.74 -8.36 3 3 0 55 275.421 3 ↓
Lo Low (pH 4.5-6) 2.99 7.18 -26.86 4 3 1 56 276.429 3 ↓

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

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