UCSF

ZINC08729752

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2007 17 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) 3.41 1.28 -9.94 0 3 0 35 226.231 2

Vendor Notes

Note Type Comments Provided By
melting_point 102 - 104 KeyOrganics
MP 102-104° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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