UCSF

ZINC20246996

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 16 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) 0.94 6.74 -41.51 1 6 1 66 223.256 2
Mid Mid (pH 6-8) 0.94 4.27 -9.25 0 6 0 65 222.248 2

Vendor Notes

Note Type Comments Provided By
BP 130°/1mm Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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