General Information of the Compound
| Compound ID |
CP0524433
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| Compound Name |
US8637501, 59
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| Structure |
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| Formula |
C24H29N5O
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| Molecular Weight |
403.53
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| Canonical SMILES |
Cn1c2CCCNCc2c2ccc(cc12)N1CCN(CCc2ccccn2)CC1=O
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| InChI |
InChI=1S/C24H29N5O/c1-27-22-6-4-10-25-16-21(22)20-8-7-19(15-23(20)27)29-14-13-28(17-24(29)30)12-9-18-5-2-3-11-26-18/h2-3,5,7-8,11,15,25H,4,6,9-10,12-14,16-17H2,1H3
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| InChIKey |
RAQKCXGJMKJCJF-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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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