General Information of the Compound
| Compound ID |
CP0373188
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| Compound Name |
(R)-2-(7-(4-fluoro-N-methylbenzamido)-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl)acetic acid
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| Structure |
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| Formula |
C22H21FN2O3
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| Molecular Weight |
380.419
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| Canonical SMILES |
CN([C@@H]1CCc2c(CC(O)=O)c3ccccc3n2C1)C(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C22H21FN2O3/c1-24(22(28)14-6-8-15(23)9-7-14)16-10-11-20-18(12-21(26)27)17-4-2-3-5-19(17)25(20)13-16/h2-9,16H,10-13H2,1H3,(H,26,27)/t16-/m1/s1
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| InChIKey |
YQQWBAZTWWZARI-MRXNPFEDSA-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