UCSF

ZINC19885190

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 14 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) 1.50 5.51 -48.69 2 3 1 43 198.217 5
Mid Mid (pH 6-8) 1.50 4.1 -7.44 1 3 0 38 197.209 5

Vendor Notes

Note Type Comments Provided By
MP 160 - 162 Enamine Building Blocks
MP 160...162 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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