UCSF

ZINC30714939

Substance Information

In ZINC since Heavy atoms Benign functionality
April 1st, 2009 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) 2.23 4.73 -9.22 1 2 0 29 262.534 3

Vendor Notes

Note Type Comments Provided By
Melting_Point 129-132? Alfa-Aesar
Melting_Point 129-132° Alfa-Aesar
Purity 95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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