UCSF

ZINC40178240

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 34 Yes

Popular Name: N'-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(3,4-dimethoxyphenyl)oxazol-5-yl]-N,N-dimethyl-et N'-[4-(2,3-dihydro-1,4-benzodiox…

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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) 2.44 2.8 -58.95 2 10 1 114 490.558 9 ↓
Hi High (pH 8-9.5) 2.44 1.3 -49.46 1 10 0 116 489.55 9 ↓
Hi High (pH 8-9.5) 2.44 0.32 -16.78 1 10 0 112 489.55 9 ↓

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