General Information of the Compound
| Compound ID |
CP0575549
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| Compound Name |
4-[3-[(4-carbamoylphenyl)carbamoyl]-2-methoxyanilino]-6-(cyclopropanecarbonylamino)-N-(trideuteriomethyl)pyridazine-3-carboxamide
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| Structure |
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| Formula |
C25H25N7O5
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| Molecular Weight |
506.5373053
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| Canonical SMILES |
[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)C(N)=O)c1OC
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| InChI |
InChI=1S/C25H25N7O5/c1-27-25(36)20-18(12-19(31-32-20)30-23(34)14-6-7-14)29-17-5-3-4-16(21(17)37-2)24(35)28-15-10-8-13(9-11-15)22(26)33/h3-5,8-12,14H,6-7H2,1-2H3,(H2,26,33)(H,27,36)(H,28,35)(H2,29,30,31,34)/i1D3
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| InChIKey |
ADHZSGRTYJGYQC-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