General Information of the Compound
| Compound ID |
CP0218531
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| Compound Name |
6-[[(1R,2S)-2-aminocyclohexyl]amino]-4-[(6-methylpyridin-2-yl)amino]pyridazine-3-carboxamide
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| Structure |
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| Formula |
C17H23N7O
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| Molecular Weight |
341.419
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| Canonical SMILES |
Cc1cccc(Nc2cc(N[C@@H]3CCCC[C@@H]3N)nnc2C(N)=O)n1
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| InChI |
InChI=1S/C17H23N7O/c1-10-5-4-8-14(20-10)22-13-9-15(23-24-16(13)17(19)25)21-12-7-3-2-6-11(12)18/h4-5,8-9,11-12H,2-3,6-7,18H2,1H3,(H2,19,25)(H2,20,21,22,23)/t11-,12+/m0/s1
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| InChIKey |
LQCUMLOMFBTKNQ-NWDGAFQWSA-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