General Information of the Compound
| Compound ID |
CP0570862
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| Compound Name |
5-[[5-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(piperidin-4-ylmethylamino)pyridin-2-yl]amino]pyrazine-2-carbonitrile
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| Structure |
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| Formula |
C19H21N9O
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| Molecular Weight |
391.439
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| Canonical SMILES |
Cc1noc(n1)-c1cnc(Nc2cnc(cn2)C#N)cc1NCC1CCNCC1
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| InChI |
InChI=1S/C19H21N9O/c1-12-26-19(29-28-12)15-10-25-17(27-18-11-22-14(7-20)9-24-18)6-16(15)23-8-13-2-4-21-5-3-13/h6,9-11,13,21H,2-5,8H2,1H3,(H2,23,24,25,27)
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| InChIKey |
DLCWOIUMTMBPNM-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