UCSF

ZINC02384764

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 23 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 3.22 -0.57 -44.66 1 5 -1 78 310.329 5

Vendor Notes

Note Type Comments Provided By
Mp [°C] 146.8 - 148.1 Acros Organics
MP 147-153 °C(lit.) Indofine
Melting_Point 147-153? Alfa-Aesar
Melting_Point 147-153° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Matrix Scientific
Melting_Point ca 130? Alfa-Aesar
Melting_Point ca 130° Alfa-Aesar
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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