General Information of the Compound
| Compound ID |
CP0955683
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| Compound Name |
2-hydroxy-3-(2-(isopropylamino)-3,4-dioxocyclobut-1-enylamino)-N,N-dimethylbenzamide
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| Formula |
C16H19N3O4
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| Molecular Weight |
317.345
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| Canonical SMILES |
CC(C)/N=c1\c(O)c(O)\c1=N/c1cccc(C(=O)N(C)C)c1O
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| InChI |
InChI=1S/C16H19N3O4/c1-8(2)17-11-12(15(22)14(11)21)18-10-7-5-6-9(13(10)20)16(23)19(3)4/h5-8,20-22H,1-4H3/b17-11-,18-12-
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| InChIKey |
RFMVCJGCUOAXLY-WHYMJUELSA-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