UCSF

ZINC01756169

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 8 Yes

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) 1.62 2.8 -6.29 1 2 0 29 150.996 0

Vendor Notes

Note Type Comments Provided By
Melting_Point ca 248? dec. Alfa-Aesar
Melting_Point ca 248° dec. Alfa-Aesar

Activity (Go SEA)

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