UCSF

ZINC35785837

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2009 18 No

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) -4.34 2.69 -82.07 4 8 0 131 264.278 12
Hi High (pH 8-9.5) -4.34 0.64 -122.69 3 8 -1 130 263.27 12

Activity (Go SEA)

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