UCSF

ZINC05075164

Substance Information

In ZINC since Heavy atoms Benign functionality
January 19th, 2006 14 Yes

Other Names:

MFCD02172429

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) 1.26 6.27 -10.52 1 5 0 58 189.222 1
Lo Low (pH 4.5-6) 1.26 6.6 -29.41 2 5 1 59 190.23 1

Vendor Notes

Note Type Comments Provided By
MP 302 - 304 Enamine Building Blocks
MP 302...304 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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