General Information of the Compound
| Compound ID |
CP0475916
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| Compound Name |
(4-Isopropyl-piperazin-1-yl)-{2-[(2-methoxy-ethylamino)-methyl]-thiazol-4-yl}-methanone
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| Structure |
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| Formula |
C15H26N4O2S
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| Molecular Weight |
326.466
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| Canonical SMILES |
COCCNCc1nc(cs1)C(=O)N1CCN(CC1)C(C)C
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| InChI |
InChI=1S/C15H26N4O2S/c1-12(2)18-5-7-19(8-6-18)15(20)13-11-22-14(17-13)10-16-4-9-21-3/h11-12,16H,4-10H2,1-3H3
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| InChIKey |
UDTKKXJBAUFIGP-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