General Information of the Compound
| Compound ID |
CP0055133
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| Compound Name |
(R)-2-(7-(N,1-dimethyl-1H-pyrazole-4-sulfonamido)-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl)acetic acid
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| Structure |
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| Formula |
C19H22N4O4S
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| Molecular Weight |
402.476
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| Canonical SMILES |
CN([C@@H]1CCc2c(CC(O)=O)c3ccccc3n2C1)S(=O)(=O)c1cnn(C)c1
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| InChI |
InChI=1S/C19H22N4O4S/c1-21-12-14(10-20-21)28(26,27)22(2)13-7-8-18-16(9-19(24)25)15-5-3-4-6-17(15)23(18)11-13/h3-6,10,12-13H,7-9,11H2,1-2H3,(H,24,25)/t13-/m1/s1
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| InChIKey |
YBRCCTKNDQHCPN-CYBMUJFWSA-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