UCSF

ZINC34682764

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 34 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) 6.38 16.07 -48.24 1 3 1 25 471.518 6
Mid Mid (pH 6-8) 6.38 13.83 -8.85 0 3 0 24 470.51 6

Activity (Go SEA)

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