UCSF

ZINC02035036

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2004 8 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) -0.38 -0.07 -8.33 1 3 0 46 113.116 0
Ref Reference (pH 7) -0.38 -0.07 -8.33 1 3 0 46 113.116 0

Vendor Notes

Note Type Comments Provided By
MP 61 - 63 Enamine Building Blocks
MP 61...63 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0661308B1; EP0661310B1; US5756623 IBM Patent Data

Activity (Go SEA)

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