UCSF

ZINC35406227

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2009 27 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) -0.47 2.93 -16.56 1 8 0 84 381.473 10
Mid Mid (pH 6-8) -0.47 5.2 -50.02 2 8 1 85 382.481 10

Activity (Go SEA)

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