General Information of the Compound
| Compound ID |
CP0446681
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| Compound Name |
6-tert-Butyl-2-[(R)-4-(4-chloro-[1,2,5]thiadiazol-3-yl)-2-methyl-piperazin-1-yl]-1H-benzoimidazole
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| Structure |
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| Formula |
C18H23ClN6S
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| Molecular Weight |
390.944
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| Canonical SMILES |
C[C@@H]1CN(CCN1c1nc2ccc(cc2[nH]1)C(C)(C)C)c1nsnc1Cl
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| InChI |
InChI=1S/C18H23ClN6S/c1-11-10-24(16-15(19)22-26-23-16)7-8-25(11)17-20-13-6-5-12(18(2,3)4)9-14(13)21-17/h5-6,9,11H,7-8,10H2,1-4H3,(H,20,21)/t11-/m1/s1
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| InChIKey |
SYVWHVIFQNSLMI-LLVKDONJSA-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