General Information of the Compound
| Compound ID |
CP0463328
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| Compound Name |
4-(N,N-bis-methylsulfonyl)-8-methoxy-3-methyl-1-propyl-imidazo[1,5-a]pyrido[3,2-e]pyrazine
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| Structure |
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| Formula |
C16H21N5O5S2
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| Molecular Weight |
427.508
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| Canonical SMILES |
CCCc1nc(C)c2c(nc3ccc(OC)nc3n12)N(S(C)(=O)=O)S(C)(=O)=O
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| InChI |
InChI=1S/C16H21N5O5S2/c1-6-7-12-17-10(2)14-16(21(27(4,22)23)28(5,24)25)18-11-8-9-13(26-3)19-15(11)20(12)14/h8-9H,6-7H2,1-5H3
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| InChIKey |
BBXLNMHPPGLPDM-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