General Information of the Compound
| Compound ID |
CP0002876
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| Compound Name |
N-[(2R)-1-[4-(cyclopropanecarbonyl)piperazin-1-yl]propan-2-yl]-2-(4-fluorophenyl)-4-propyl-1,3-oxazole-5-carboxamide
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| Structure |
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| Formula |
C24H31FN4O3
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| Molecular Weight |
442.535
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| Canonical SMILES |
CCCc1nc(oc1C(=O)N[C@H](C)CN1CCN(CC1)C(=O)C1CC1)-c1ccc(F)cc1
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| InChI |
InChI=1S/C24H31FN4O3/c1-3-4-20-21(32-23(27-20)17-7-9-19(25)10-8-17)22(30)26-16(2)15-28-11-13-29(14-12-28)24(31)18-5-6-18/h7-10,16,18H,3-6,11-15H2,1-2H3,(H,26,30)/t16-/m1/s1
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| InChIKey |
CIMPXJQCDKNSDO-MRXNPFEDSA-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