UCSF

ZINC05203794

Substance Information

In ZINC since Heavy atoms Benign functionality
January 25th, 2006 26 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) 4.00 6.49 -14.4 3 6 0 96 351.358 5
Hi High (pH 8-9.5) 4.00 7.48 -52.71 2 6 -1 99 350.35 5

Activity (Go SEA)

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