UCSF

ZINC67975726

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 26 Yes

Popular Name: [4-hydroxy-4-(5-methyl-2-pyridyl)-1-piperidyl]-(1,8-naphthyridin-2-yl)methanone [4-hydroxy-4-(5-methyl-2-pyridyl…

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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) 1.56 6.12 -16.84 1 6 0 79 348.406 2 ↓
Lo Low (pH 4.5-6) 1.56 6.64 -38.89 2 6 1 80 349.414 2 ↓

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

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