UCSF

ZINC04280536

Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2005 18 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) 3.50 1.03 -8.68 1 2 0 37 242.249 3

Vendor Notes

Note Type Comments Provided By
melting_point 1.890000000000000e+002 - 1.900000000000000e+002 KeyOrganics
melting_point 189 - 190 KeyOrganics
MP 189-190° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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