UCSF

ZINC05551463

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2006 27 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) 5.50 8.87 -16.11 1 5 0 60 380.469 6
Mid Mid (pH 6-8) 5.50 8.4 -47.12 0 5 -1 63 379.461 6

Activity (Go SEA)

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