UCSF

ZINC26318585

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2009 23 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 5.89 -10.12 1 5 0 65 400.294 6
Mid Mid (pH 6-8) 4.00 5.96 -41.17 0 5 -1 67 399.286 6

Activity (Go SEA)

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