UCSF

ZINC37492267

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 26th, 2009 19 Yes

Popular Name: 4-chloro-2-hydroxy-N-[2-(3-pyridyl)ethyl]benzamide 4-chloro-2-hydroxy-N-[2-(3-pyrid…

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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) 2.84 4.67 -13.08 2 4 0 62 276.723 4 ↓
Hi High (pH 8-9.5) 2.84 5.68 -53.89 1 4 -1 65 275.715 4 ↓
Lo Low (pH 4.5-6) 2.84 5.14 -42.42 3 4 1 63 277.731 4 ↓

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

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