UCSF

ZINC05096419

Substance Information

In ZINC since Heavy atoms Benign functionality
January 21st, 2006 32 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) 4.57 1.57 -15.03 1 5 0 56 431.58 10

Activity (Go SEA)

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