UCSF

ZINC22814346

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 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) 0.80 1.47 -10.55 1 5 0 48 296.44 5
Mid Mid (pH 6-8) 0.80 3.74 -35.42 2 5 1 50 297.448 5

Activity (Go SEA)

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