UCSF

ZINC14007251

Substance Information

In ZINC since Heavy atoms Benign functionality
July 1st, 2008 15 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) 3.12 7.24 -8.08 1 2 0 33 266.138 3

Vendor Notes

Note Type Comments Provided By
MP 70-71° Matrix Scientific
melting_point 84 - 86 KeyOrganics
MP 84-86° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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