UCSF

ZINC09303851

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2007 21 Yes

Popular Name: 9-amino-4-(2,4-difluorophenyl)-7-thia-5-azabicyclo[4.3.0]nona-2,4,8,10-tetraene-8-carboxamide 9-amino-4-(2,4-difluorophenyl)-7…

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) 2.62 2.93 -13.94 4 4 0 82 305.309 2 ↓
Lo Low (pH 4.5-6) 2.62 3.05 -35.48 5 4 1 83 306.317 2 ↓

Activity (Go SEA)

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