General Information of the Compound
| Compound ID |
CP0159504
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| Compound Name |
(2S)-2-(1-hydroxysilinan-1-yl)-2-(4-methoxyphenyl)-N,N-dimethylethanamine
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| Structure |
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| Formula |
C16H27NO2Si
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| Molecular Weight |
293.483
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| Canonical SMILES |
COc1ccc(cc1)[C@@H](CN(C)C)[Si]1(O)CCCCC1
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| InChI |
InChI=1S/C16H27NO2Si/c1-17(2)13-16(20(18)11-5-4-6-12-20)14-7-9-15(19-3)10-8-14/h7-10,16,18H,4-6,11-13H2,1-3H3/t16-/m1/s1
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| InChIKey |
KIXBFSFRCBHKLN-MRXNPFEDSA-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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