General Information of the Compound
| Compound ID |
CP0570868
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| Compound Name |
ethyl 2-[(8-chloro-1,2,3,5,6,7-hexahydro-s-indacen-4-yl)carbamoylamino]acetate
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| Formula |
C17H21ClN2O3
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| Molecular Weight |
336.819
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| Canonical SMILES |
CCOC(=O)CNC(=O)Nc1c2CCCc2c(Cl)c2CCCc12
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| InChI |
InChI=1S/C17H21ClN2O3/c1-2-23-14(21)9-19-17(22)20-16-12-7-3-5-10(12)15(18)11-6-4-8-13(11)16/h2-9H2,1H3,(H2,19,20,22)
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| InChIKey |
QSJYPVMBFJVNHQ-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