UCSF

ZINC26520883

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 22 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 3.00 3.46 -14.5 2 6 0 77 303.314 5
Hi High (pH 8-9.5) 3.00 4.45 -58.67 1 6 -1 80 302.306 5

Activity (Go SEA)

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