General Information of the Compound
| Compound ID |
CP0468742
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| Compound Name |
2-amino-4-(methylamino)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
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| Structure |
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| Formula |
C8H8N6
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| Molecular Weight |
188.194
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| Canonical SMILES |
CNc1nc(N)nc2[nH]cc(C#N)c12
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| InChI |
InChI=1S/C8H8N6/c1-11-6-5-4(2-9)3-12-7(5)14-8(10)13-6/h3H,1H3,(H4,10,11,12,13,14)
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| InChIKey |
HAPBUHBPFMBCFR-UHFFFAOYSA-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