UCSF

ZINC43435362

Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2010 18 No

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) 1.92 4.82 -39.3 3 5 1 72 259.37 9
Mid Mid (pH 6-8) 1.92 3.85 -10.4 2 5 0 67 258.362 9

Activity (Go SEA)

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