General Information of the Compound
| Compound ID |
CP0257988
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| Compound Name |
(R)-2-(7-(4-fluoro-N-(2,2,2-trifluoroethyl)phenylsulfonamido)-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl)acetic acid
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| Structure |
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| Formula |
C22H20F4N2O4S
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| Molecular Weight |
484.471
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| Canonical SMILES |
OC(=O)Cc1c2CC[C@H](Cn2c2ccccc12)N(CC(F)(F)F)S(=O)(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C22H20F4N2O4S/c23-14-5-8-16(9-6-14)33(31,32)28(13-22(24,25)26)15-7-10-20-18(11-21(29)30)17-3-1-2-4-19(17)27(20)12-15/h1-6,8-9,15H,7,10-13H2,(H,29,30)/t15-/m1/s1
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| InChIKey |
OELVPGVSMLPSGD-OAHLLOKOSA-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