UCSF

ZINC35829757

Substance Information

In ZINC since Heavy atoms Benign functionality
October 13th, 2009 35 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 4.70 13.4 -15.89 0 6 0 50 486.641 9
Mid Mid (pH 6-8) 4.70 15.66 -68.54 1 6 1 51 487.649 9

Activity (Go SEA)

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