General Information of the Compound
| Compound ID |
CP0337846
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| Compound Name |
2-(6-chloro-1-methylindazol-3-yl)-N-[(2S)-1-hydroxypropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide
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| Structure |
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| Formula |
C18H17ClN6O2
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| Molecular Weight |
384.827
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| Canonical SMILES |
C[C@@H](CO)NC(=O)c1c[nH]c2ncc(nc12)-c1nn(C)c2cc(Cl)ccc12
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| InChI |
InChI=1S/C18H17ClN6O2/c1-9(8-26)22-18(27)12-6-20-17-16(12)23-13(7-21-17)15-11-4-3-10(19)5-14(11)25(2)24-15/h3-7,9,26H,8H2,1-2H3,(H,20,21)(H,22,27)/t9-/m0/s1
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| InChIKey |
INNBDJOVFDAQNL-VIFPVBQESA-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