General Information of the Compound
| Compound ID |
CP0203712
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| Compound Name |
(S)-3-(2-amino-3-phenylpropoxy)-N-ethyl-6-(furan-3-yl)-5-(3-methyl-1H-pyrazolo[4,3-b]pyrazin-5-yl)pyridin-2-amine
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| Structure |
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| Formula |
C26H27N7O2
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| Molecular Weight |
469.549
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| Canonical SMILES |
CCNc1nc(-c2ccoc2)c(cc1OC[C@@H](N)Cc1ccccc1)-c1cnc2[nH]nc(C)c2n1
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| InChI |
InChI=1S/C26H27N7O2/c1-3-28-25-22(35-15-19(27)11-17-7-5-4-6-8-17)12-20(24(31-25)18-9-10-34-14-18)21-13-29-26-23(30-21)16(2)32-33-26/h4-10,12-14,19H,3,11,15,27H2,1-2H3,(H,28,31)(H,29,32,33)/t19-/m0/s1
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| InChIKey |
CEKSBBZAKLNEBU-IBGZPJMESA-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