General Information of the Compound
Compound ID |
CP0569416
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Compound Name |
US11254663, Example 440
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Structure |
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Formula |
C34H41FN4O3
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Molecular Weight |
572.725
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Canonical SMILES |
CCOc1ccc(cn1)-c1cccc(c1)N(CC12CCC(CC1)(CC2)c1noc(n1)C(C)(C)C)C(=O)C12CC(F)(C1)C2
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InChI |
InChI=1S/C34H41FN4O3/c1-5-41-26-10-9-24(18-36-26)23-7-6-8-25(17-23)39(29(40)33-19-34(35,20-33)21-33)22-31-11-14-32(15-12-31,16-13-31)27-37-28(42-38-27)30(2,3)4/h6-10,17-18H,5,11-16,19-22H2,1-4H3
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InChIKey |
LZAAIKZDZIQENI-UHFFFAOYSA-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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PubChem ID |
Map of Molecular Bioactivity Related to the Compound
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