UCSF

ZINC19927114

Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 38 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) 2.83 9.24 -49.52 4 13 1 160 518.558 10
Hi High (pH 8-9.5) 2.83 6.7 -20.34 3 13 0 159 517.55 10

Activity (Go SEA)

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