General Information of the Compound
| Compound ID |
CP0095468
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| Compound Name |
(2S)-1-N-[4-methyl-5-[2-(1-methylcyclopropyl)-1,3-thiazol-4-yl]-1,3-thiazol-2-yl]pyrrolidine-1,2-dicarboxamide
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| Structure |
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| Formula |
C17H21N5O2S2
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| Molecular Weight |
391.522
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| Canonical SMILES |
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1csc(n1)C1(C)CC1
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| InChI |
InChI=1S/C17H21N5O2S2/c1-9-12(10-8-25-14(20-10)17(2)5-6-17)26-15(19-9)21-16(24)22-7-3-4-11(22)13(18)23/h8,11H,3-7H2,1-2H3,(H2,18,23)(H,19,21,24)/t11-/m0/s1
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| InChIKey |
XXOWXPDAXYCGMQ-NSHDSACASA-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