General Information of the Compound
| Compound ID |
CP0162671
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| Compound Name |
(R)-2-(7-(4-fluorophenylsulfonamido)-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl)acetic acid
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| Structure |
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| Formula |
C20H19FN2O4S
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| Molecular Weight |
402.447
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| Canonical SMILES |
OC(=O)Cc1c2CC[C@H](Cn2c2ccccc12)NS(=O)(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C20H19FN2O4S/c21-13-5-8-15(9-6-13)28(26,27)22-14-7-10-19-17(11-20(24)25)16-3-1-2-4-18(16)23(19)12-14/h1-6,8-9,14,22H,7,10-12H2,(H,24,25)/t14-/m1/s1
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| InChIKey |
ZYXLFPFPUDKFET-CQSZACIVSA-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