General Information of the Compound
| Compound ID |
CP0186275
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| Compound Name |
(2S)-1-N-[4-methyl-5-(2-pyridin-3-yl-1,3-thiazol-4-yl)-1,3-thiazol-2-yl]pyrrolidine-1,2-dicarboxamide
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| Structure |
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| Formula |
C18H18N6O2S2
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| Molecular Weight |
414.516
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| Canonical SMILES |
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1csc(n1)-c1cccnc1
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| InChI |
InChI=1S/C18H18N6O2S2/c1-10-14(12-9-27-16(22-12)11-4-2-6-20-8-11)28-17(21-10)23-18(26)24-7-3-5-13(24)15(19)25/h2,4,6,8-9,13H,3,5,7H2,1H3,(H2,19,25)(H,21,23,26)/t13-/m0/s1
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| InChIKey |
RFKSRRZJNFPXGR-ZDUSSCGKSA-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