General Information of the Compound
| Compound ID |
CP0508100
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| Compound Name |
spiro[1,3-dihydroquinazoline-4,1'-cyclohexane]-2-one
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| Structure |
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| Formula |
C13H16N2O
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| Molecular Weight |
216.284
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| Canonical SMILES |
O=C1Nc2ccccc2C2(CCCCC2)N1
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| InChI |
InChI=1S/C13H16N2O/c16-12-14-11-7-3-2-6-10(11)13(15-12)8-4-1-5-9-13/h2-3,6-7H,1,4-5,8-9H2,(H2,14,15,16)
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| InChIKey |
ZGVAHJCPAGIFMR-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