General Information of the Compound
| Compound ID |
CP0567525
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| Compound Name |
N-methyl-6-oxo-N-[(1S)-1-phenylethyl]-2-pyrazol-1-yl-1H-pyrimidine-5-carboxamide
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| Formula |
C17H17N5O2
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| Molecular Weight |
323.356
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| Canonical SMILES |
C[C@H](N(C)C(=O)c1cnc(nc1O)-n1cccn1)c1ccccc1
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| InChI |
InChI=1S/C17H17N5O2/c1-12(13-7-4-3-5-8-13)21(2)16(24)14-11-18-17(20-15(14)23)22-10-6-9-19-22/h3-12H,1-2H3,(H,18,20,23)/t12-/m0/s1
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| InChIKey |
CVHOQOPDJIKLLT-LBPRGKRZSA-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