UCSF

ZINC60019090

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2011 25 No

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) -1.56 8.33 -43.54 2 5 1 53 350.527 12

Activity (Go SEA)

Rings

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