UCSF

ZINC43646317

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2010 20 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.49 7.7 -39.95 1 4 1 40 292.277 8
Hi High (pH 8-9.5) 2.49 5.34 -6.39 0 4 0 39 291.269 8

Activity (Go SEA)

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