General Information of the Compound
| Compound ID |
CP0475378
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| Compound Name |
(2R)-1-(2-methyl-1-(naphthalen-2-yl)propan-2-ylamino)-3-(1-phenylbutoxy)propan-2-ol
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| Structure |
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| Formula |
C27H35NO2
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| Molecular Weight |
405.582
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| Canonical SMILES |
CCCC(OC[C@H](O)CNC(C)(C)Cc1ccc2ccccc2c1)c1ccccc1
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| InChI |
InChI=1S/C27H35NO2/c1-4-10-26(23-12-6-5-7-13-23)30-20-25(29)19-28-27(2,3)18-21-15-16-22-11-8-9-14-24(22)17-21/h5-9,11-17,25-26,28-29H,4,10,18-20H2,1-3H3/t25-,26?/m1/s1
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| InChIKey |
IDKVKNVGEAMACJ-DCWQJPKNSA-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