General Information of the Compound
| Compound ID |
CP0372502
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| Compound Name |
[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-[4-(1-methyl-4H-indeno[1,2-c]pyrazol-6-yl)-5-pyridin-4-ylfuran-2-yl]methanone
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| Structure |
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| Formula |
C29H32N6O2
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| Molecular Weight |
496.615
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| Canonical SMILES |
CN(C)CCN1CCN(CC1)C(=O)c1cc(c(o1)-c1ccncc1)-c1ccc-2c(Cc3cnn(C)c-23)c1
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| InChI |
InChI=1S/C29H32N6O2/c1-32(2)10-11-34-12-14-35(15-13-34)29(36)26-18-25(28(37-26)20-6-8-30-9-7-20)21-4-5-24-22(16-21)17-23-19-31-33(3)27(23)24/h4-9,16,18-19H,10-15,17H2,1-3H3
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| InChIKey |
QRPUOEBNLLSBRF-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