General Information of the Compound
| Compound ID |
CP0480011
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| Compound Name |
1'-benzylspiro[3H-chromene-2,4'-piperidine]-4-one
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| Structure |
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| Formula |
C20H21NO2
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| Molecular Weight |
307.393
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| Canonical SMILES |
O=C1CC2(CCN(Cc3ccccc3)CC2)Oc2ccccc12
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| InChI |
InChI=1S/C20H21NO2/c22-18-14-20(23-19-9-5-4-8-17(18)19)10-12-21(13-11-20)15-16-6-2-1-3-7-16/h1-9H,10-15H2
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| InChIKey |
VYTXCPHULMDKCP-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