General Information of the Compound
| Compound ID |
CP0895134
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| Compound Name |
2-[(3R)-3-Methylmorpholin-4-yl]-8-(1H-pyrazol-5-yl)-4-(pyridin-3-ylethynyl)-1,7-naphthyridine
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| Structure |
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| Formula |
C23H20N6O
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| Molecular Weight |
396.454
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| Canonical SMILES |
C[C@@H]1COCCN1c1cc(C#Cc2cccnc2)c2ccnc(-c3ccn[nH]3)c2n1
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| InChI |
InChI=1S/C23H20N6O/c1-16-15-30-12-11-29(16)21-13-18(5-4-17-3-2-8-24-14-17)19-6-9-25-23(22(19)27-21)20-7-10-26-28-20/h2-3,6-10,13-14,16H,11-12,15H2,1H3,(H,26,28)/t16-/m1/s1
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| InChIKey |
RWXHVVLROWZSKK-MRXNPFEDSA-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