General Information of the Compound
| Compound ID |
CP0430166
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| Compound Name |
(2S,5R,6S)-2-(2-Methoxy-phenyl)-6-phenyl-1,7-diaza-spiro[4.5]decane
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| Structure |
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| Formula |
C21H26N2O
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| Molecular Weight |
322.452
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| Canonical SMILES |
COc1ccccc1[C@@H]1CC[C@@]2(CCCN[C@H]2c2ccccc2)N1
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| InChI |
InChI=1S/C21H26N2O/c1-24-19-11-6-5-10-17(19)18-12-14-21(23-18)13-7-15-22-20(21)16-8-3-2-4-9-16/h2-6,8-11,18,20,22-23H,7,12-15H2,1H3/t18-,20-,21+/m0/s1
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| InChIKey |
LKTJRLOXOYSXCH-SESVDKBCSA-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