UCSF

ZINC20418787

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 20 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) 2.07 5.75 -51.74 2 6 1 75 282.364 9
Mid Mid (pH 6-8) 2.07 6.87 -41.43 2 6 1 72 282.364 9

Activity (Go SEA)

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