UCSF

ZINC13119001

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 29th, 2008 19 No

Popular Name: 3-methyl-1-phenyl-4-(2-thienylmethylene)-2-pyrazolin-5-one 3-methyl-1-phenyl-4-(2-thienylme…

Find On: PubMed — Wikipedia — Google

CAS Number: 132603-50-0

Other Names:

MFCD01325070

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) 2.75 8.46 -13.57 0 3 0 35 268.341 2 ↓

Activity (Go SEA)

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