General Information of the Compound
| Compound ID |
CP0501422
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| Compound Name |
6''-phenylspiro[cyclohexane-1,4''-(1'',2'',3'',4''-tetrahydroquinazoline)]-2''-one
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| Structure |
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| Formula |
C19H20N2O
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| Molecular Weight |
292.382
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| Canonical SMILES |
O=C1Nc2ccc(cc2C2(CCCCC2)N1)-c1ccccc1
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| InChI |
InChI=1S/C19H20N2O/c22-18-20-17-10-9-15(14-7-3-1-4-8-14)13-16(17)19(21-18)11-5-2-6-12-19/h1,3-4,7-10,13H,2,5-6,11-12H2,(H2,20,21,22)
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| InChIKey |
SGXBSOQUFFRORI-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