General Information of the Compound
| Compound ID |
CP0212068
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| Compound Name |
US8604061, 343
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| Structure |
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| Formula |
C10H11ClN2O2
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| Molecular Weight |
226.663
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| Canonical SMILES |
NC1=N[C@@H](COc2cccc(Cl)c2)CO1
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| InChI |
InChI=1S/C10H11ClN2O2/c11-7-2-1-3-9(4-7)14-5-8-6-15-10(12)13-8/h1-4,8H,5-6H2,(H2,12,13)/t8-/m0/s1
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| InChIKey |
CKZPYDQAKLAGKM-QMMMGPOBSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound