General Information of the Compound
| Compound ID |
CP0471737
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| Compound Name |
CHEMBL4584322
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| Formula |
C23H24N4O3
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| Molecular Weight |
404.47
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| Canonical SMILES |
Nc1c(C(=O)N[C@H]2CC[C@H](CC2)c2ccccc2)n(-c2ccccc2)c(=O)[nH]c1=O
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| InChI |
InChI=1S/C23H24N4O3/c24-19-20(27(23(30)26-21(19)28)18-9-5-2-6-10-18)22(29)25-17-13-11-16(12-14-17)15-7-3-1-4-8-15/h1-10,16-17H,11-14,24H2,(H,25,29)(H,26,28,30)/t16-,17+
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| InChIKey |
OZJCVDROTRKHCV-CALCHBBNSA-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