UCSF

ZINC59416949

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 4th, 2011 32 No

Popular Name: (4E)-1-(3,4-dimethylphenyl)-4-[[5-(4-methoxy-2-nitro-phenyl)-2-furyl]methylene]pyrazolidine-3,5-dion (4E)-1-(3,4-dimethylphenyl)-4-[[…

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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) 4.24 11.67 -21.02 1 9 0 123 433.42 5 ↓
Hi High (pH 8-9.5) 4.69 9.92 -72.78 0 9 -1 126 432.412 5 ↓

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

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