General Information of the Compound
| Compound ID |
CP0550119
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| Compound Name |
(4R)-4-[[3-(2-methylpyridin-4-yl)-1H-indazol-5-yl]amino]-3,4-dihydro-2H-chromene-7-carbonitrile
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| Formula |
C23H19N5O
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| Molecular Weight |
381.439
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| Canonical SMILES |
Cc1cc(ccn1)-c1n[nH]c2ccc(N[C@@H]3CCOc4cc(ccc34)C#N)cc12
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| InChI |
InChI=1S/C23H19N5O/c1-14-10-16(6-8-25-14)23-19-12-17(3-5-21(19)27-28-23)26-20-7-9-29-22-11-15(13-24)2-4-18(20)22/h2-6,8,10-12,20,26H,7,9H2,1H3,(H,27,28)/t20-/m1/s1
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| InChIKey |
AFCXAERUVDFGQF-HXUWFJFHSA-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