UCSF

ZINC39886289

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 18 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) -1.36 -1.11 -12.05 4 8 0 126 287.326 3
Hi High (pH 8-9.5) -1.73 -3.06 -42.23 3 8 -1 132 286.318 3

Activity (Go SEA)

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