UCSF

ZINC13276048

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 13th, 2008 32 No

Popular Name: 3-[(2R)-2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(cyclopropanecarbonyl)-4-hydroxy-5-oxo-2H-py 3-[(2R)-2-(5-chloro-2,3-dihydro-…

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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) 3.17 10.41 -131.34 0 8 -2 119 453.834 5 ↓
Mid Mid (pH 6-8) 2.58 9.39 -80.5 0 8 -1 113 454.842 5 ↓
Mid Mid (pH 6-8) 3.17 8.08 -88.14 1 8 -1 116 454.842 4 ↓

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

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