General Information of the Compound
| Compound ID |
CP0449299
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| Compound Name |
(2-Hydroxy-ethyl)-carbamic acid 4-[(2-methoxy-benzoylamino)-methyl]-4-phenyl-cyclohexyl ester
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| Formula |
C24H30N2O5
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| Molecular Weight |
426.513
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| Canonical SMILES |
COc1ccccc1C(=O)NC[C@@]1(CC[C@@H](CC1)OC(=O)NCCO)c1ccccc1
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| InChI |
InChI=1S/C24H30N2O5/c1-30-21-10-6-5-9-20(21)22(28)26-17-24(18-7-3-2-4-8-18)13-11-19(12-14-24)31-23(29)25-15-16-27/h2-10,19,27H,11-17H2,1H3,(H,25,29)(H,26,28)/t19-,24-
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| InChIKey |
KRMMNVYQRZEFBH-OGAOHHHESA-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