UCSF

ZINC49545611

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 19 Yes

Popular Name: (7S)-7-(4-chlorophenyl)-2-(methylamino)-6,7-dihydro-4H-thiazolo[4,5-b]pyridin-5-one (7S)-7-(4-chlorophenyl)-2-(methy…

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) 2.77 5.71 -11.3 2 4 0 54 293.779 2 ↓
Lo Low (pH 4.5-6) 2.95 4.4 -35.66 3 4 1 59 294.787 2 ↓

Activity (Go SEA)

Rings

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