UCSF

ZINC03860149

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 9 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) 1.97 5.18 -5.35 0 1 0 17 124.183 1

Vendor Notes

Note Type Comments Provided By
BP [°C] 201 - 202 Acros Organics
Mp [°C] 73 Acros Organics
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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