UCSF

ZINC16713762

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2008 33 No

Popular Name: (5R)-5-(3-bromophenyl)-3-hydroxy-4-(4-isobutoxy-2-methyl-benzoyl)-1-(3-methoxypropyl)-5H-pyrrol-2-on (5R)-5-(3-bromophenyl)-3-hydroxy…

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) 4.97 11.6 -55.38 0 6 -1 79 515.424 10 ↓
Mid Mid (pH 6-8) 5.42 10.09 -24.96 1 6 0 76 516.432 9 ↓
Mid Mid (pH 6-8) 4.39 11.49 -18.27 0 6 0 73 516.432 10 ↓

Activity (Go SEA)

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