General Information of the Compound
| Compound ID |
CP0350607
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| Compound Name |
US9303015, 18
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| Structure |
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| Formula |
C27H21Cl2N3O3
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| Molecular Weight |
506.389
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| Canonical SMILES |
COc1c(Oc2ccccc2)c(Cl)nc2ccc(cc12)C(O)(c1cncn1C)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C27H21Cl2N3O3/c1-32-16-30-15-23(32)27(33,17-8-11-19(28)12-9-17)18-10-13-22-21(14-18)24(34-2)25(26(29)31-22)35-20-6-4-3-5-7-20/h3-16,33H,1-2H3
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| InChIKey |
SWUYOUYKNRCXJY-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