UCSF

ZINC20265197

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 35 No

Popular Name: (5R)-4-(4-chlorobenzoyl)-5-(4-ethoxy-3-methoxy-phenyl)-3-hydroxy-1-(2-morpholinoethyl)-5H-pyrrol-2-o (5R)-4-(4-chlorobenzoyl)-5-(4-et…

Find On: PubMed — Wikipedia — Google

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) 2.95 7.75 -54.99 0 8 -1 91 499.971 9 ↓
Mid Mid (pH 6-8) 2.95 10.1 -70.75 1 8 0 93 500.979 9 ↓
Lo Low (pH 4.5-6) 2.95 9.28 -58.13 2 8 1 90 501.987 9 ↓

Activity (Go SEA)

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