General Information of the Compound
| Compound ID |
CP0543315
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| Compound Name |
(4R)-4-[[3-(2,6-dimethylpyridin-4-yl)-1H-indazol-5-yl]amino]-3,4-dihydro-2H-chromene-7-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 |
Cc1cc(cc(C)n1)-c1n[nH]c2ccc(N[C@@H]3CCOc4cc(ccc34)C#N)cc12
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| InChI |
InChI=1S/C24H21N5O/c1-14-9-17(10-15(2)26-14)24-20-12-18(4-6-22(20)28-29-24)27-21-7-8-30-23-11-16(13-25)3-5-19(21)23/h3-6,9-12,21,27H,7-8H2,1-2H3,(H,28,29)/t21-/m1/s1
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| InChIKey |
DEQWHDRZTQUHTK-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