UCSF

ZINC31915597

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 24 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) 5.80 12.68 -26.02 1 3 1 28 341.862 5
Mid Mid (pH 6-8) 5.80 12.3 -8.94 0 3 0 27 340.854 5

Activity (Go SEA)

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