UCSF

ZINC39763739

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2010 32 Yes

Popular Name: 4-chloro-N-[2-[4-methyl-5-[(1R)-1-methyl-2-(3-methylsulfanylanilino)-2-oxo-ethyl]sulfanyl-1,2,4-tria 4-chloro-N-[2-[4-methyl-5-[(1R)-…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 3.73 11.02 -22.81 2 7 0 89 490.054 9 ↓

Activity (Go SEA)

Rings

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