UCSF

ZINC26334792

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2009 20 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) 2.05 7.15 -43.32 2 4 1 43 277.388 7
Hi High (pH 8-9.5) 2.05 5.4 -11.76 1 4 0 42 276.38 7

Activity (Go SEA)

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