General Information of the Compound
| Compound ID |
CP0567388
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| Compound Name |
5-[[5-(1-methylindazol-5-yl)-4-[[(2R)-morpholin-2-yl]methylamino]pyridin-2-yl]amino]pyrazine-2-carbonitrile
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| Formula |
C23H23N9O
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| Molecular Weight |
441.499
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| Canonical SMILES |
Cn1ncc2cc(ccc12)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1
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| InChI |
InChI=1S/C23H23N9O/c1-32-21-3-2-15(6-16(21)9-30-32)19-13-29-22(31-23-14-26-17(8-24)10-28-23)7-20(19)27-12-18-11-25-4-5-33-18/h2-3,6-7,9-10,13-14,18,25H,4-5,11-12H2,1H3,(H2,27,28,29,31)/t18-/m1/s1
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| InChIKey |
LIYUTUKKRBDUGR-GOSISDBHSA-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