UCSF

ZINC16756767

Substance Information

In ZINC since Heavy atoms Benign functionality
September 7th, 2008 24 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) 1.67 5.51 -16.67 2 7 0 93 330.388 4
Mid Mid (pH 6-8) 1.67 6.03 -43.73 3 7 1 94 331.396 4

Activity (Go SEA)

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