UCSF

ZINC23283326

Substance Information

In ZINC since Heavy atoms Benign functionality
December 28th, 2008 20 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) 3.32 5.81 -28.85 1 5 -1 81 279.222 4
Lo Low (pH 4.5-6) 3.32 5.03 -15.29 2 5 0 78 280.23 4

Activity (Go SEA)

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