General Information of the Compound
| Compound ID |
CP0957581
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| Compound Name |
MOTILIN_007
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| Structure |
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| Formula |
C26H35FN4O2
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| Molecular Weight |
454.59
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| Canonical SMILES |
COc1cc(CC(=O)N2CCC(Nc3cccc(F)c3)CC2)ccc1CN1CCN[C@@H](C)C1
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| InChI |
InChI=1S/C26H35FN4O2/c1-19-17-30(13-10-28-19)18-21-7-6-20(14-25(21)33-2)15-26(32)31-11-8-23(9-12-31)29-24-5-3-4-22(27)16-24/h3-7,14,16,19,23,28-29H,8-13,15,17-18H2,1-2H3/t19-/m0/s1
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| InChIKey |
RZUVFLXHPIZOTG-IBGZPJMESA-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