UCSF

ZINC06265812

Substance Information

In ZINC since Heavy atoms Benign functionality
March 17th, 2006 31 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) 1.56 8.37 -51.04 2 8 1 101 424.477 9
Mid Mid (pH 6-8) 0.98 9.03 -60.68 1 8 1 98 424.477 9

Activity (Go SEA)

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