UCSF

ZINC06475665

Substance Information

In ZINC since Heavy atoms Benign functionality
March 31st, 2006 23 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) 1.70 3.48 -16.01 1 7 0 93 338.385 5
Hi High (pH 8-9.5) 1.33 0.92 -51.86 0 7 -1 99 337.377 5

Activity (Go SEA)

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