General Information of the Compound
| Compound ID |
CP0310474
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| Compound Name |
4-[2-(1H-indol-4-yl)-6-(1-piperidin-4-ylsulfonylcyclopropyl)pyrimidin-4-yl]morpholine
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| Structure |
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| Formula |
C24H29N5O3S
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| Molecular Weight |
467.595
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| Canonical SMILES |
O=S(=O)(C1CCNCC1)C1(CC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
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| InChI |
InChI=1S/C24H29N5O3S/c30-33(31,17-4-9-25-10-5-17)24(7-8-24)21-16-22(29-12-14-32-15-13-29)28-23(27-21)19-2-1-3-20-18(19)6-11-26-20/h1-3,6,11,16-17,25-26H,4-5,7-10,12-15H2
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| InChIKey |
IAWCCBHFNQNWSY-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