UCSF

ZINC26196385

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2009 16 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) 0.69 -0.45 -10.75 2 5 0 61 227.308 5
Mid Mid (pH 6-8) 0.69 1.94 -46.23 3 5 1 63 228.316 5

Activity (Go SEA)

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