UCSF

ZINC06273783

Substance Information

In ZINC since Heavy atoms Benign functionality
March 17th, 2006 25 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) 3.22 12.13 -15.15 1 6 0 69 338.411 5
Mid Mid (pH 6-8) 3.40 12.69 -51.55 2 6 1 74 339.419 5

Activity (Go SEA)

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