UCSF

ZINC39237983

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 10th, 2010 34 Yes

Popular Name: (2E,5S)-5-(4-methoxyphenyl)-7-methyl-3-oxo-N-phenyl-2-[[(2R)-2H-pyrrol-2-yl]methylene]-5H-thiazolo[3 (2E,5S)-5-(4-methoxyphenyl)-7-me…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 4.90 9.23 -14.61 1 7 0 85 470.554 5 ↓
Lo Low (pH 4.5-6) 4.90 10.22 -46.14 2 7 1 87 471.562 5 ↓

Activity (Go SEA)

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