UCSF

ZINC12463244

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2008 19 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) -0.43 6.91 -61.38 2 8 1 97 270.313 7
Mid Mid (pH 6-8) -0.43 7.33 -93.9 3 8 2 98 271.321 7

Activity (Go SEA)

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