UCSF

ZINC20758212

Substance Information

In ZINC since Heavy atoms Benign functionality
November 28th, 2008 34 Yes

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) 2.62 9.02 -13.64 1 7 0 69 458.562 5

Activity (Go SEA)

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