UCSF

ZINC00032982

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 Yes

Popular Name: 4-methyl-N-(3-pyridyl)benzamide 4-methyl-N-(3-pyridyl)benzamide

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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) 2.21 -0.01 -9.06 1 3 0 42 212.252 2 ↓
Lo Low (pH 4.5-6) 2.21 0.1 -38.33 2 3 1 43 213.26 2 ↓

Activity (Go SEA)

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