UCSF

ZINC59539711

Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2011 11 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) -0.20 -0.96 -5.96 2 3 0 49 195.309 5
Hi High (pH 8-9.5) -0.20 -0.15 -39.9 2 3 -1 49 194.301 5

Activity (Go SEA)

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