General Information of the Compound
| Compound ID |
CP0542317
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| Compound Name |
4-[[(1R,3R,4R)-3-hydroxy-4-methylcyclohexyl]amino]-2-[(1-methylcyclopropyl)amino]pyrimidine-5-carboxamide
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| Structure |
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| Formula |
C16H25N5O2
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| Molecular Weight |
319.409
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| Canonical SMILES |
C[C@@H]1CC[C@H](C[C@H]1O)Nc1nc(NC2(C)CC2)ncc1C(N)=O
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| InChI |
InChI=1S/C16H25N5O2/c1-9-3-4-10(7-12(9)22)19-14-11(13(17)23)8-18-15(20-14)21-16(2)5-6-16/h8-10,12,22H,3-7H2,1-2H3,(H2,17,23)(H2,18,19,20,21)/t9-,10-,12-/m1/s1
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| InChIKey |
SAAFPELODWNTEY-CKYFFXLPSA-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