UCSF

ZINC35017439

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 35 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) 3.63 12.98 -89.27 1 11 -2 169 497.485 10
Mid Mid (pH 6-8) 4.39 14.08 -59.06 2 11 -1 163 498.493 11

Activity (Go SEA)

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