UCSF

ZINC05445216

Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2006 27 No

Other Names:

MFCD02048191

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) 3.53 0.86 -45.52 2 5 1 62 385.871 5
Mid Mid (pH 6-8) 2.50 0.68 -46.58 1 5 1 58 385.871 6

Activity (Go SEA)

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