UCSF

ZINC24991885

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2009 27 Yes

Popular Name: N-[3-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]phenyl]methanesulfonamide N-[3-[(2S)-2-(1H-benzimidazol-2-…

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Download: MOL2 SDF SMILES Flexibase

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) 1.69 4.65 -56.35 1 7 -1 97 383.453 4 ↓
Lo Low (pH 4.5-6) 1.69 5.16 -54.41 2 7 0 98 384.461 4 ↓
Lo Low (pH 4.5-6) 1.69 4.58 -21.27 2 7 0 95 384.461 4 ↓

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

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