General Information of the Compound
| Compound ID |
CP0275565
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| Compound Name |
4-(5-methyl-4-oxochromen-3-yl)-N-[(1S)-6-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
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| Structure |
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| Formula |
C33H34N2O3
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| Molecular Weight |
506.646
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| Canonical SMILES |
Cc1cccc2occ(-c3ccc(cc3)C(=O)N[C@H]3CCCc4cc(CN5CCCCC5)ccc34)c(=O)c12
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| InChI |
InChI=1S/C33H34N2O3/c1-22-7-5-10-30-31(22)32(36)28(21-38-30)24-12-14-25(15-13-24)33(37)34-29-9-6-8-26-19-23(11-16-27(26)29)20-35-17-3-2-4-18-35/h5,7,10-16,19,21,29H,2-4,6,8-9,17-18,20H2,1H3,(H,34,37)/t29-/m0/s1
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| InChIKey |
VQEYUCNVVZABSK-LJAQVGFWSA-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