General Information of the Compound
| Compound ID |
CP0857170
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| Compound Name |
MOTILIN_034
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| Structure |
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| Formula |
C25H26F2N4O
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| Molecular Weight |
436.506
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| Canonical SMILES |
C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4cccc(F)c4)nc3)c(F)c2)CCN1
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| InChI |
InChI=1S/C25H26F2N4O/c1-17-15-31(11-10-28-17)16-18-6-9-24(22(27)12-18)30(2)25(32)20-7-8-23(29-14-20)19-4-3-5-21(26)13-19/h3-9,12-14,17,28H,10-11,15-16H2,1-2H3/t17-/m0/s1
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| InChIKey |
BONCPJJHOMEUCG-KRWDZBQOSA-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