General Information of the Compound
| Compound ID |
CP0568099
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| Compound Name |
(5R)-5-[[3-(2-methoxypyridin-4-yl)-1H-indazol-5-yl]amino]-5,6,7,8-tetrahydronaphthalene-2-carbonitrile
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| Structure |
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| Formula |
C24H21N5O
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| Molecular Weight |
395.466
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| Canonical SMILES |
COc1cc(ccn1)-c1n[nH]c2ccc(N[C@@H]3CCCc4cc(ccc34)C#N)cc12
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| InChI |
InChI=1S/C24H21N5O/c1-30-23-12-17(9-10-26-23)24-20-13-18(6-8-22(20)28-29-24)27-21-4-2-3-16-11-15(14-25)5-7-19(16)21/h5-13,21,27H,2-4H2,1H3,(H,28,29)/t21-/m1/s1
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| InChIKey |
YFBGUHBSUBUYSQ-OAQYLSRUSA-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