General Information of the Compound
| Compound ID |
CP0509046
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| Compound Name |
US9012651, 227
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| Structure |
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| Formula |
C21H34N2OSSi
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| Molecular Weight |
390.669
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| Canonical SMILES |
CC(C)[C@H](CO)NCc1cccc(n1)-c1ccc(s1)[Si](C)(C)C(C)(C)C
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| InChI |
InChI=1S/C21H34N2OSSi/c1-15(2)18(14-24)22-13-16-9-8-10-17(23-16)19-11-12-20(25-19)26(6,7)21(3,4)5/h8-12,15,18,22,24H,13-14H2,1-7H3/t18-/m0/s1
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| InChIKey |
HWINCIAAEKHODY-SFHVURJKSA-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