General Information of the Compound
| Compound ID |
CP0118041
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| Compound Name |
US10214477, Example 5
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| Structure |
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| Formula |
C15H22N2
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| Molecular Weight |
230.355
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| Canonical SMILES |
NC1CCC(CC1)N[C@@H]1C[C@H]1c1ccccc1
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| InChI |
InChI=1S/C15H22N2/c16-12-6-8-13(9-7-12)17-15-10-14(15)11-4-2-1-3-5-11/h1-5,12-15,17H,6-10,16H2/t12?,13?,14-,15+/m0/s1
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| InChIKey |
ALHBJBCQLJZYON-PFSRBDOWSA-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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Table of Molecular Bioactivities Related to the Compound