UCSF

ZINC10052017

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 19th, 2007 19 Yes

Popular Name: 2-(butyl-methyl-amino)-N-(2-cyanophenyl)-propanamide 2-(butyl-methyl-amino)-N-(2-cyan…

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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) 2.62 2.78 -37.12 2 4 1 57 260.361 6 ↓

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