General Information of the Compound
| Compound ID |
CP0332215
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| Compound Name |
N-[5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxo-7-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-14-yl]methanesulfonamide
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| Structure |
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| Formula |
C22H23N3O5S
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| Molecular Weight |
441.509
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| Canonical SMILES |
CS(=O)(=O)Nc1ccc2ccc3ncc(cc3c(=O)c2c1)N1CCC2(CC1)OCCO2
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| InChI |
InChI=1S/C22H23N3O5S/c1-31(27,28)24-16-4-2-15-3-5-20-19(21(26)18(15)12-16)13-17(14-23-20)25-8-6-22(7-9-25)29-10-11-30-22/h2-5,12-14,24H,6-11H2,1H3
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| InChIKey |
XPOKTAOPEQLJEW-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