General Information of the Compound
| Compound ID |
CP0957582
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| Compound Name |
MOTILIN_009
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| Structure |
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| Formula |
C25H32FN3O2
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| Molecular Weight |
425.548
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| Canonical SMILES |
C[C@@H]1CN(Cc2ccc(CC(=O)N3CCC(Oc4ccc(F)cc4)CC3)cc2)CCN1
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| InChI |
InChI=1S/C25H32FN3O2/c1-19-17-28(15-12-27-19)18-21-4-2-20(3-5-21)16-25(30)29-13-10-24(11-14-29)31-23-8-6-22(26)7-9-23/h2-9,19,24,27H,10-18H2,1H3/t19-/m1/s1
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| InChIKey |
KSEDDRMAVJRIFE-LJQANCHMSA-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