General Information of the Compound
| Compound ID |
CP0568148
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| Compound Name |
(2R)-2-[[2-[(2,3-difluorophenyl)methylsulfanyl]pyrido[2,3-d]pyrimidin-4-yl]amino]propan-1-ol
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| Structure |
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| Formula |
C17H16F2N4OS
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| Molecular Weight |
362.405
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| Canonical SMILES |
C[C@H](CO)Nc1nc(SCc2cccc(F)c2F)nc2ncccc12
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| InChI |
InChI=1S/C17H16F2N4OS/c1-10(8-24)21-16-12-5-3-7-20-15(12)22-17(23-16)25-9-11-4-2-6-13(18)14(11)19/h2-7,10,24H,8-9H2,1H3,(H,20,21,22,23)/t10-/m1/s1
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| InChIKey |
CMLHBXOFXLCXGW-SNVBAGLBSA-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