UCSF

ZINC34856541

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 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) 3.03 4.94 -11.09 3 13 0 159 483.533 11
Lo Low (pH 4.5-6) 3.03 7.26 -35.51 4 13 1 160 484.541 11

Activity (Go SEA)

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