UCSF

ZINC09421789

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2007 27 No

Popular Name: 9-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylene]-7,7-dioxo-7$l^{6}-thia-8-azabicyclo[4.4.0]deca-2,4 9-[(3,5-dimethyl-1-phenyl-pyrazo…

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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) 2.72 -2.82 -15.64 1 6 0 81 379.441 2 ↓
Hi High (pH 8-9.5) 2.72 -2.45 -47.7 0 6 -1 83 378.433 2 ↓

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

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