General Information of the Compound
| Compound ID |
CP0512066
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| Compound Name |
US9120797, 52
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| Structure |
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| Formula |
C24H26FNOS2
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| Molecular Weight |
427.61
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| Canonical SMILES |
CN(C)C1(CCC2(CC1)c1sc3ccccc3c1CCS2=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C24H26FNOS2/c1-26(2)23(17-7-9-18(25)10-8-17)12-14-24(15-13-23)22-20(11-16-29(24)27)19-5-3-4-6-21(19)28-22/h3-10H,11-16H2,1-2H3
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| InChIKey |
FTMRGQOSQDXGTG-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