UCSF

ZINC39763097

Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2010 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) 1.95 8.15 -18.41 1 10 0 132 380.411 7
Hi High (pH 8-9.5) 2.14 6.94 -37.82 0 10 -1 138 379.403 7

Activity (Go SEA)

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