UCSF

ZINC12412799

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 14th, 2008 20 No

Popular Name: 2-(4-bromophenyl)-5-methyl-4-(2-thienylmethylene)-2,4-dihydro-3H-pyrazol-3-one 2-(4-bromophenyl)-5-methyl-4-(2-…

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Other Names:

MFCD00489526

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) 3.56 9.08 -11.55 0 3 0 35 347.237 2 ↓
Ref Reference (pH 7) 3.56 8.57 -9.35 0 3 0 35 347.237 2 ↓

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