UCSF

ZINC05053243

Substance Information

In ZINC since Heavy atoms Benign functionality
January 18th, 2006 15 Yes

Other Names:

MFCD00835067

MFCD12137510

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) 3.43 4.51 -12.44 1 3 0 46 208.305 2
Hi High (pH 8-9.5) 3.89 3.7 -49.24 0 3 -1 49 207.297 2

Vendor Notes

Note Type Comments Provided By
MP 163 - 165 Enamine Building Blocks
MP 163...165 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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