UCSF

ZINC26980960

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2009 18 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) -3.27 -4.12 -45.37 6 9 0 158 278.205 6
Mid Mid (pH 6-8) -3.27 -2.97 -100.77 5 9 -1 161 277.197 6

Activity (Go SEA)

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