UCSF

ZINC33764768

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2009 37 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 4.03 11.58 -16.09 1 7 0 65 524.662 11
Mid Mid (pH 6-8) 4.03 13.92 -52.51 2 7 1 66 525.67 11

Activity (Go SEA)

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