UCSF

ZINC20898758

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 29th, 2008 18 No

Popular Name: (4R)-3-methyl-4-phenyl-4,8-dihydro-1H-pyrazolo[5,4-e][1,4]thiazepin-7-one (4R)-3-methyl-4-phenyl-4,8-dihyd…

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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) 1.71 5.26 -7.21 2 4 0 58 259.334 1 ↓
Mid Mid (pH 6-8) 1.90 2.88 -7.37 2 4 0 61 259.334 1 ↓
Mid Mid (pH 6-8) 1.71 5.25 -8.72 2 4 0 58 259.334 1 ↓

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