UCSF

ZINC02087804

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 26 No

Popular Name: ethyl 4-chloro-2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)hydrazono]-3-oxobutanoate ethyl 4-chloro-2-[(1,5-dimethyl-…

Find On: PubMed — Wikipedia — Google

Other Names:

MFCD02943849

Download: MOL2 SDF SMILES Flexibase

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) 2.64 8.31 -19.72 1 8 0 95 378.816 8 ↓
Ref Reference (pH 7) 2.64 9.5 -24.48 1 8 0 95 378.816 8 ↓

Activity (Go SEA)

Rings

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

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