UCSF

ZINC06015915

Substance Information

In ZINC since Heavy atoms Benign functionality
February 24th, 2006 21 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) 2.01 3.08 -13.92 2 5 0 75 308.334 4
Mid Mid (pH 6-8) 2.01 3.09 -50 1 5 -1 77 307.326 4

Activity (Go SEA)

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