UCSF

ZINC12938134

Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2008 12 No

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) 0.88 4.5 -11.27 0 3 0 60 155.16 1
Lo Low (pH 4.5-6) 0.88 4.78 -45.02 1 3 1 62 156.168 1

Activity (Go SEA)

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