UCSF

ZINC02510137

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 12 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) 3.20 2.32 -6.03 0 3 0 45 165.192 3

Vendor Notes

Note Type Comments Provided By
Melting_Point 14? Alfa-Aesar
Melting_Point 14° Alfa-Aesar
Boiling_Point 96-100?/2mm Alfa-Aesar
Boiling_Point 96-100°/2mm Alfa-Aesar

Activity (Go SEA)

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