UCSF

ZINC49548746

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 20 No

Popular Name: (4S)-4-(1-ethyl-3-methyl-pyrazol-4-yl)-1-methyl-4,8-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one (4S)-4-(1-ethyl-3-methyl-pyrazol…

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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) 0.72 3.11 -9.67 1 6 0 68 291.38 2 ↓
Ref Reference (pH 7) 0.53 5.47 -9.44 1 6 0 65 291.38 2 ↓

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

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