UCSF

ZINC69771646

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2011 24 Yes

Popular Name: N-[(1S)-1-(2-oxoindolin-5-yl)ethyl]-1H-benzimidazole-2-carboxamide N-[(1S)-1-(2-oxoindolin-5-yl)eth…

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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) 1.83 4.71 -11.98 3 6 0 87 320.352 3 ↓
Lo Low (pH 4.5-6) 1.83 5.24 -37.91 4 6 1 88 321.36 3 ↓

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

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