General Information of the Compound
| Compound ID |
CP0006780
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| Compound Name |
2-(4-fluorophenyl)-4-propyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]-1,3-oxazole-5-carboxamide
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| Structure |
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| Formula |
C25H30FN5O2
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| Molecular Weight |
451.546
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| Canonical SMILES |
CCCc1nc(oc1C(=O)NC(C)CN1CCN(CC1)c1ccccn1)-c1ccc(F)cc1
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| InChI |
InChI=1S/C25H30FN5O2/c1-3-6-21-23(33-25(29-21)19-8-10-20(26)11-9-19)24(32)28-18(2)17-30-13-15-31(16-14-30)22-7-4-5-12-27-22/h4-5,7-12,18H,3,6,13-17H2,1-2H3,(H,28,32)
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| InChIKey |
OULLPXCGBDZCBG-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