General Information of the Compound
| Compound ID |
CP0010798
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| Compound Name |
US10307413, Compound 3
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| Structure |
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| Formula |
C19H22N2O2
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| Molecular Weight |
310.397
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| Canonical SMILES |
O[C@@H](CNC(=O)c1ccccc1)CN1CCc2ccccc2C1
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| InChI |
InChI=1S/C19H22N2O2/c22-18(12-20-19(23)16-7-2-1-3-8-16)14-21-11-10-15-6-4-5-9-17(15)13-21/h1-9,18,22H,10-14H2,(H,20,23)/t18-/m0/s1
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| InChIKey |
JYSFCCVCBMGCMA-SFHVURJKSA-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