UCSF

ZINC34894351

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2009 26 Yes

Popular Name: 2-phenyl-1-(3-pyridylBLAHyl)ethanone 2-phenyl-1-(3-pyridylBLAHyl)etha…

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Vendors

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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) 2.33 9.68 -42.72 1 4 1 38 348.47 3 ↓
Lo Low (pH 4.5-6) 2.33 10.14 -111.22 2 4 2 39 349.478 3 ↓

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

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