UCSF

ZINC05095240

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 20th, 2006 26 No

Popular Name: 4-amino-2-(4-hydroxyphenyl)-9-(p-tolyl)-5-oxa-7,8-diazabicyclo[4.3.0]nona-3,6,9-triene-3-carbonitril 4-amino-2-(4-hydroxyphenyl)-9-(p…

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) 2.86 2.98 -9.78 4 6 0 108 344.374 2 ↓
Mid Mid (pH 6-8) 2.86 2.32 -9.19 4 6 0 108 344.374 2 ↓
Lo Low (pH 4.5-6) 2.86 3.18 -57.61 5 6 1 110 345.382 2 ↓

Activity (Go SEA)

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