UCSF

ZINC26839253

Substance Information

In ZINC since Heavy atoms Benign functionality
February 10th, 2009 29 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) -5.18 -6.41 -122.1 13 14 1 264 417.447 14
Hi High (pH 8-9.5) -5.18 -6.81 -80.13 12 14 0 263 416.439 14

Activity (Go SEA)

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