General Information of the Compound
| Compound ID |
CP0552765
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| Compound Name |
ethyl 2-(2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),8-trien-8-ylcarbamoylamino)acetate
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| Formula |
C16H21N3O3
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| Molecular Weight |
303.362
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| Canonical SMILES |
CCOC(=O)CNC(=O)Nc1c2CCCc2nc2CCCc12
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| InChI |
InChI=1S/C16H21N3O3/c1-2-22-14(20)9-17-16(21)19-15-10-5-3-7-12(10)18-13-8-4-6-11(13)15/h2-9H2,1H3,(H2,17,18,19,21)
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| InChIKey |
ZCPWCAOKNIJLLX-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