UCSF

ZINC04812812

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 5th, 2006 27 No

Popular Name: 4-amino-2-(3-hydroxy-4-methoxy-phenyl)-9-phenyl-5-oxa-7,8-diazabicyclo[4.3.0]nona-3,8,10-triene-3-ca 4-amino-2-(3-hydroxy-4-methoxy-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) 2.23 2.23 -11.74 4 7 0 117 360.373 3 ↓
Lo Low (pH 4.5-6) 2.23 2.52 -63.01 5 7 1 119 361.381 3 ↓

Activity (Go SEA)

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