General Information of the Compound
| Compound ID |
CP0851099
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| Compound Name |
MOTILIN_058
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| Structure |
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| Formula |
C24H24F4N4O2S
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| Molecular Weight |
508.541
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| Canonical SMILES |
C[C@H]1CN(Cc2ccc(NS(=O)(=O)c3ccc(-c4ccc(F)cc4)nc3)cc2C(F)(F)F)CCN1
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| InChI |
InChI=1S/C24H24F4N4O2S/c1-16-14-32(11-10-29-16)15-18-4-7-20(12-22(18)24(26,27)28)31-35(33,34)21-8-9-23(30-13-21)17-2-5-19(25)6-3-17/h2-9,12-13,16,29,31H,10-11,14-15H2,1H3/t16-/m0/s1
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| InChIKey |
IHSRDRQVXGIMBU-INIZCTEOSA-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