General Information of the Compound
| Compound ID |
CP0572950
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| Compound Name |
6-(cyclopropanecarbonylamino)-4-[2-methoxy-3-[(2-oxo-1,3-dihydroindol-5-yl)carbamoyl]anilino]-N-(trideuteriomethyl)pyridazine-3-carboxamide
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| Structure |
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| Formula |
C26H25N7O5
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| Molecular Weight |
518.5483053
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| Canonical SMILES |
[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc3NC(=O)Cc3c2)c1OC
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| InChI |
InChI=1S/C26H25N7O5/c1-27-26(37)22-19(12-20(32-33-22)31-24(35)13-6-7-13)29-18-5-3-4-16(23(18)38-2)25(36)28-15-8-9-17-14(10-15)11-21(34)30-17/h3-5,8-10,12-13H,6-7,11H2,1-2H3,(H,27,37)(H,28,36)(H,30,34)(H2,29,31,32,35)/i1D3
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| InChIKey |
XHRITBKBVLPGPU-FIBGUPNXSA-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