UCSF

ZINC02560494

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 13 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) 3.87 0.71 -45.9 0 2 -1 40 250.156 9

Vendor Notes

Note Type Comments Provided By
BP 160°/1 Torr Matrix Scientific
Melting_Point 38-41? Alfa-Aesar
MP 39-40° Matrix Scientific
MP 42 TCI
Purity 95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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