UCSF

ZINC04585336

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2005 31 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) 3.69 -0.93 -49.05 3 6 1 65 423.581 9

Activity (Go SEA)

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