UCSF

ZINC59415608

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 4th, 2011 32 No

Popular Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N'-[(E)-(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene 4-(1H-benzimidazol-2-ylsulfanylm…

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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) 4.55 10.69 -41.78 3 7 0 96 511.401 7 ↓
Hi High (pH 8-9.5) 4.62 9.16 -49.31 2 7 -1 102 510.393 7 ↓

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

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