General Information of the Compound
| Compound ID |
CP0122485
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| Compound Name |
6-[[(1R,2S)-2-aminocyclohexyl]amino]-4-[(5,6-dimethoxypyridin-2-yl)amino]pyridazine-3-carboxamide
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| Structure |
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| Formula |
C18H25N7O3
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| Molecular Weight |
387.444
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| Canonical SMILES |
COc1ccc(Nc2cc(N[C@@H]3CCCC[C@@H]3N)nnc2C(N)=O)nc1OC
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| InChI |
InChI=1S/C18H25N7O3/c1-27-13-7-8-14(23-18(13)28-2)22-12-9-15(24-25-16(12)17(20)26)21-11-6-4-3-5-10(11)19/h7-11H,3-6,19H2,1-2H3,(H2,20,26)(H2,21,22,23,24)/t10-,11+/m0/s1
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| InChIKey |
STNAXKXNXRFLMU-WDEREUQCSA-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