General Information of the Compound
| Compound ID |
CP0188712
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| Compound Name |
(8R)-8-methyl-11-oxa-3,4,6,19,24-pentazatetracyclo[18.3.1.02,6.012,17]tetracosa-1(24),2,4,12,14,16,20,22-octaen-18-one
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| Structure |
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| Formula |
C19H19N5O2
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| Molecular Weight |
349.394
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| Canonical SMILES |
C[C@@H]1CCOc2ccccc2C(=O)Nc2cccc(n2)-c2nncn2C1
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| InChI |
InChI=1S/C19H19N5O2/c1-13-9-10-26-16-7-3-2-5-14(16)19(25)22-17-8-4-6-15(21-17)18-23-20-12-24(18)11-13/h2-8,12-13H,9-11H2,1H3,(H,21,22,25)/t13-/m1/s1
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| InChIKey |
JHLDGTLZDAJJHT-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