UCSF

ZINC02652184

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2004 26 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) 3.20 7.37 -60.89 3 5 1 63 370.326 6
Hi High (pH 8-9.5) 3.20 5.15 -17.36 2 5 0 61 369.318 6

Activity (Go SEA)

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