General Information of the Compound
| Compound ID |
CP0373051
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| Compound Name |
7-[(4-fluorophenyl)methyl]-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine
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| Structure |
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| Formula |
C21H25FN6
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| Molecular Weight |
380.471
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| Canonical SMILES |
Nc1n[nH]c2nc(N3CCCCC3)c3CN(Cc4ccc(F)cc4)CCc3c12
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| InChI |
InChI=1S/C21H25FN6/c22-15-6-4-14(5-7-15)12-27-11-8-16-17(13-27)21(28-9-2-1-3-10-28)24-20-18(16)19(23)25-26-20/h4-7H,1-3,8-13H2,(H3,23,24,25,26)
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| InChIKey |
CZXWFPDCLBUEGE-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