General Information of the Compound
| Compound ID |
CP0931905
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| Compound Name |
MOTILIN_017
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| Structure |
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| Formula |
C26H35FN4O
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| Molecular Weight |
438.591
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| Canonical SMILES |
C[C@H]1CN(Cc2ccc(N(C)C(=O)C3CCN(Cc4cccc(F)c4)CC3)cc2)CCN1
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| InChI |
InChI=1S/C26H35FN4O/c1-20-17-31(15-12-28-20)18-21-6-8-25(9-7-21)29(2)26(32)23-10-13-30(14-11-23)19-22-4-3-5-24(27)16-22/h3-9,16,20,23,28H,10-15,17-19H2,1-2H3/t20-/m0/s1
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| InChIKey |
PMPMXKFVIUFUSI-FQEVSTJZSA-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