UCSF

ZINC44572483

Substance Information

In ZINC since Heavy atoms Benign functionality
July 16th, 2010 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) 3.22 9.04 -49.11 2 6 1 86 277.348 7
Hi High (pH 8-9.5) 3.22 6.31 -8.52 1 6 0 85 276.34 7

Activity (Go SEA)

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