UCSF

ZINC00058274

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 19 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) 2.91 -1.29 -10.49 1 4 0 54 252.273 2

Vendor Notes

Note Type Comments Provided By
MP 238 - 240 Enamine Building Blocks
MP 238...240 Enamine Building Blocks
MP 240-244 °C(lit.) Indofine
MP 244o C Indofine
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
SOLUBILITY Soluble in DMSO Indofine

Activity (Go SEA)

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