UCSF

ZINC12465155

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2008 25 No

Download: MOL2 SDF SMILES Flexibase

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) 5.19 10.94 -9.22 0 4 0 38 351.475 4
Ref Reference (pH 7) 5.19 10.46 -9.17 0 4 0 38 351.475 4

Activity (Go SEA)

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