General Information of the Compound
| Compound ID |
CP0807280
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| Compound Name |
rac-4-(1-Cyclohexylethyl)-7H-pyrrolo[2,3-d]pyrimidine hydrochloride
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| Structure |
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| Formula |
C14H20ClN3
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| Molecular Weight |
265.788
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| Canonical SMILES |
CC(c1ncnc2[nH]ccc12)C1CCCCC1.Cl
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| InChI |
InChI=1S/C14H19N3.ClH/c1-10(11-5-3-2-4-6-11)13-12-7-8-15-14(12)17-9-16-13;/h7-11H,2-6H2,1H3,(H,15,16,17);1H
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| InChIKey |
LMUDLCFADSTXEF-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