UCSF

ZINC00388041

Substance Information

In ZINC since Heavy atoms Benign functionality
December 5th, 2005 9 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) 1.14 4.54 -25.94 1 2 1 17 123.179 1

Vendor Notes

Note Type Comments Provided By
Boiling_Point 190-192? Alfa-Aesar
Boiling_Point 190-192° Alfa-Aesar

Activity (Go SEA)

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