UCSF

ZINC16946115

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2008 17 Yes

Popular Name: 5-(3-Methoxyphenyl)nicotinic acid 5-(3-Methoxyphenyl)nicotinic acid

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CAS Numbers: 97000-30-1 , [97000-30-1]

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) 2.25 5.04 -47.82 0 4 -1 62 228.227 3 ↓

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