General Information of the Compound
| Compound ID |
CP0082752
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| Compound Name |
1-Ethyl-N-(1-methylcyclopropyl)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)methyl]-2,4-dioxo-quinazoline-6-sulfonamide
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| Structure |
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| Formula |
C18H21N5O4S2
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| Molecular Weight |
435.531
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| Canonical SMILES |
CCn1c2ccc(cc2c(=O)n(Cc2nnc(C)s2)c1=O)S(=O)(=O)NC1(C)CC1
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| InChI |
InChI=1S/C18H21N5O4S2/c1-4-22-14-6-5-12(29(26,27)21-18(3)7-8-18)9-13(14)16(24)23(17(22)25)10-15-20-19-11(2)28-15/h5-6,9,21H,4,7-8,10H2,1-3H3
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| InChIKey |
ZHTUVSJVLAGDGJ-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