General Information of the Compound
| Compound ID |
CP0553446
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| Compound Name |
N-[(4-chlorophenyl)methyl]-2-(propan-2-ylamino)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxamide
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| Structure |
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| Formula |
C18H22ClN5O
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| Molecular Weight |
359.861
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| Canonical SMILES |
CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NCc1ccc(Cl)cc1
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| InChI |
InChI=1S/C18H22ClN5O/c1-12(2)22-17-20-10-14-7-8-24(11-16(14)23-17)18(25)21-9-13-3-5-15(19)6-4-13/h3-6,10,12H,7-9,11H2,1-2H3,(H,21,25)(H,20,22,23)
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| InChIKey |
NMUQYLRAMRYBOP-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