UCSF

ZINC64540363

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2011 42 No

Popular Name: (4S)-5-[(2S)-2-(1H-benzimidazole-2-carbonyl)pyrrolidin-1-yl]-4-(9H-fluoren-9-ylmethoxycarbonylamino) (4S)-5-[(2S)-2-(1H-benzimidazole…

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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) 5.36 13.59 -64.22 2 10 -1 145 565.606 10 ↓
Hi High (pH 8-9.5) 5.36 13.2 -117.32 1 10 -2 143 564.598 10 ↓

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

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