UCSF

ZINC38735548

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2010 28 No

Popular Name: N-[(S)-1H-benzimidazol-5-yl(phenyl)methyl]-3-[(5S)-3,5-dimethyl-2,5-dihydroisoxazol-4-yl]propanamide N-[(S)-1H-benzimidazol-5-yl(phen…

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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) 3.51 9.38 -15.51 3 6 0 79 376.46 6 ↓
Lo Low (pH 4.5-6) 3.51 9.85 -45.47 4 6 1 80 377.468 6 ↓

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

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