General Information of the Compound
| Compound ID |
CP0452889
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| Compound Name |
(R)-N-(1-(1-(4-(diethylcarbamoyl)phenyl)ethylcarbamoyl)cyclopropyl)pyrimidine-5-carboxamide
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| Structure |
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| Formula |
C22H27N5O3
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| Molecular Weight |
409.49
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| Canonical SMILES |
CCN(CC)C(=O)c1ccc(cc1)[C@@H](C)NC(=O)C1(CC1)NC(=O)c1cncnc1
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| InChI |
InChI=1S/C22H27N5O3/c1-4-27(5-2)20(29)17-8-6-16(7-9-17)15(3)25-21(30)22(10-11-22)26-19(28)18-12-23-14-24-13-18/h6-9,12-15H,4-5,10-11H2,1-3H3,(H,25,30)(H,26,28)/t15-/m1/s1
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| InChIKey |
UVSASTMBIWJYAJ-OAHLLOKOSA-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