UCSF

ZINC21716223

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 8th, 2008 30 Yes

Popular Name: 2-[[1-(4-chlorophenyl)-4-oxo-5H-pyrazolo[5,4-d]pyrimidin-6-yl]sulfanyl]-N-(4-ethylphenyl)acetamide 2-[[1-(4-chlorophenyl)-4-oxo-5H-…

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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) 5.14 8.29 -43.92 1 7 -1 96 438.92 6 ↓
Mid Mid (pH 6-8) 4.68 10.23 -14.78 2 7 0 93 439.928 6 ↓
Mid Mid (pH 6-8) 4.68 9.69 -16.04 2 7 0 93 439.928 6 ↓

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