General Information of the Compound
| Compound ID |
CP0284287
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| Compound Name |
5-(2-aminopyridin-4-yl)-N-[(3-fluoropyridin-2-yl)methyl]-2-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
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| Structure |
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| Formula |
C18H16FN7
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| Molecular Weight |
349.373
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| Canonical SMILES |
Cc1nc(NCc2ncccc2F)c2c(c[nH]c2n1)-c1ccnc(N)c1
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| InChI |
InChI=1S/C18H16FN7/c1-10-25-17-16(12(8-23-17)11-4-6-22-15(20)7-11)18(26-10)24-9-14-13(19)3-2-5-21-14/h2-8H,9H2,1H3,(H2,20,22)(H2,23,24,25,26)
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| InChIKey |
MGEGGAFJSKMJJD-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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