UCSF

ZINC20733357

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2008 25 No

Popular Name: (4S)-4-(3-bromophenyl)-3-methyl-1-pyrimidin-2-yl-4,8-dihydropyrazolo[5,4-e][1,4]thiazepin-7-one (4S)-4-(3-bromophenyl)-3-methyl-…

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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) 2.62 8.75 -14.88 1 6 0 76 416.304 2 ↓
Ref Reference (pH 7) 2.44 11.18 -13.92 1 6 0 73 416.304 2 ↓

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