General Information of the Compound
| Compound ID |
CP0097787
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| Compound Name |
US10562854, No. C1
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| Structure |
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| Formula |
C20H19ClN2O2
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| Molecular Weight |
354.837
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| Canonical SMILES |
Oc1c(CNCc2ccccc2)ccn(Cc2ccc(Cl)cc2)c1=O
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| InChI |
InChI=1S/C20H19ClN2O2/c21-18-8-6-16(7-9-18)14-23-11-10-17(19(24)20(23)25)13-22-12-15-4-2-1-3-5-15/h1-11,22,24H,12-14H2
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| InChIKey |
SJYNBRCAAHWFJE-UHFFFAOYSA-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