General Information of the Compound
| Compound ID |
CP0569913
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| Compound Name |
(2R)-N-cyclopropyl-N-[[1-(3-methoxypropyl)pyrrolo[3,2-b]pyridin-3-yl]methyl]morpholine-2-carboxamide
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| Structure |
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| Formula |
C20H28N4O3
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| Molecular Weight |
372.469
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| Canonical SMILES |
COCCCn1cc(CN(C2CC2)C(=O)[C@H]2CNCCO2)c2ncccc12
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| InChI |
InChI=1S/C20H28N4O3/c1-26-10-3-9-23-13-15(19-17(23)4-2-7-22-19)14-24(16-5-6-16)20(25)18-12-21-8-11-27-18/h2,4,7,13,16,18,21H,3,5-6,8-12,14H2,1H3/t18-/m1/s1
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| InChIKey |
WFDUZHSVPNCEPO-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