UCSF

ZINC59733370

Substance Information

In ZINC since Heavy atoms Benign functionality
March 9th, 2011 32 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) 0.19 -6.56 -21.72 7 11 0 190 448.38 4
Hi High (pH 8-9.5) 0.19 -5.57 -71.79 6 11 -1 193 447.372 4

Activity (Go SEA)

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