UCSF

ZINC00163359

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 11 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) 2.14 1.64 -9.25 0 2 0 26 150.177 3

Vendor Notes

Note Type Comments Provided By
Boiling_Point 132-134/15mm Alfa-Aesar
BP 245° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
MP 98 - 100 Enamine Building Blocks
MP 98...100 Enamine Building Blocks
Purity 99% Matrix Scientific
APPEARANCE clear colorless liquid Indofine
Warnings IRRITANT, AIR SENSITIVE Matrix Scientific
Warnings Irritant/Air Sensitive Matrix Scientific

Activity (Go SEA)

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