UCSF

ZINC16051619

Substance Information

In ZINC since Heavy atoms Benign functionality
August 13th, 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) 2.21 5.04 -10.73 1 6 0 66 350.496 21

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 8.58e-03 g/l DrugBank-experimental

Activity (Go SEA)

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