UCSF

ZINC09237229

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2007 17 Yes

Popular Name: 2-(2-Pyridinylmethoxy)benzoic acid 2-(2-Pyridinylmethoxy)benzoic acid

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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) 2.36 0.59 -58.65 0 4 -1 62 228.227 4 ↓
Lo Low (pH 4.5-6) 2.36 0.65 -69.14 1 4 0 63 229.235 4 ↓

Activity (Go SEA)

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