UCSF

ZINC16693930

Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2008 30 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) 2.84 8.44 -28.24 2 9 0 141 404.382 5
Hi High (pH 8-9.5) 2.84 9.22 -49.43 1 9 -1 144 403.374 5

Activity (Go SEA)

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