UCSF

ZINC63251893

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 27th, 2011 29 No

Popular Name: 2-(2H-benzimidazol-2-ylsulfanyl)-N-[(E)-[(3S,4R,5S)-3,5-dimethyl-1-phenyl-pyrazolidin-4-yl]methylene 2-(2H-benzimidazol-2-ylsulfanyl)…

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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) 3.60 6.59 -116.03 4 7 2 85 410.547 6 ↓
Lo Low (pH 4.5-6) 3.60 6.92 -174.74 5 7 3 89 411.555 6 ↓

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

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