UCSF

ZINC15009327

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2008 31 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) 5.54 14.89 -15.92 1 6 0 77 460.621 9
Lo Low (pH 4.5-6) 5.54 15.33 -37.34 2 6 1 79 461.629 9

Activity (Go SEA)

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