General Information of the Compound
| Compound ID |
CP0521695
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| Compound Name |
4-chloro-7H-pyrrolo[2,3-d]pyrimidin-2-amine
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| Structure |
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| Formula |
C6H5ClN4
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| Molecular Weight |
168.587
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| Canonical SMILES |
Nc1nc(Cl)c2cc[nH]c2n1
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| InChI |
InChI=1S/C6H5ClN4/c7-4-3-1-2-9-5(3)11-6(8)10-4/h1-2H,(H3,8,9,10,11)
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| InChIKey |
VIVLSUIQHWGALQ-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