General Information of the Compound
Compound ID |
CP0436592
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Compound Name |
N-[4-(acridin-9-ylamino)phenyl]-3-pyrrolidin-1-ylpropanamide
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Structure |
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Formula |
C26H26N4O
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Molecular Weight |
410.521
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Canonical SMILES |
O=C(CCN1CCCC1)Nc1ccc(Nc2c3ccccc3nc3ccccc23)cc1
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InChI |
InChI=1S/C26H26N4O/c31-25(15-18-30-16-5-6-17-30)27-19-11-13-20(14-12-19)28-26-21-7-1-3-9-23(21)29-24-10-4-2-8-22(24)26/h1-4,7-14H,5-6,15-18H2,(H,27,31)(H,28,29)
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InChIKey |
KAKHZXYRJRTAFG-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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ChEMBL 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