General Information of the Compound
| Compound ID |
CP0373534
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| Compound Name |
7-benzyl-5-(4-methylpiperidin-1-yl)-6,7,8,9-tetrahydro-3H-pyrazolo[3,4-c][2,7]naphthyridin-1-amine
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| Structure |
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| Formula |
C22H28N6
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| Molecular Weight |
376.508
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| Canonical SMILES |
CC1CCN(CC1)c1nc2[nH]nc(N)c2c2CCN(Cc3ccccc3)Cc12
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| InChI |
InChI=1S/C22H28N6/c1-15-7-11-28(12-8-15)22-18-14-27(13-16-5-3-2-4-6-16)10-9-17(18)19-20(23)25-26-21(19)24-22/h2-6,15H,7-14H2,1H3,(H3,23,24,25,26)
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| InChIKey |
LFMDMGSQINGLBB-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
Protein ID: PT05288, Bombesin receptor subtype-3
Protein ID: PT01996, Bombesin receptor subtype-3