General Information of the Compound
| Compound ID |
CP0239999
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| Compound Name |
(2R)-N-(adamantan-2-yl)-1-[(1-hydroxycyclohexyl)methyl]pyrrolidine-2-carboxamide
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| Structure |
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| Formula |
C22H36N2O2
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| Molecular Weight |
360.542
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| Canonical SMILES |
OC1(CN2CCC[C@@H]2C(=O)NC2C3CC4CC(C3)CC2C4)CCCCC1
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| InChI |
InChI=1S/C22H36N2O2/c25-21(23-20-17-10-15-9-16(12-17)13-18(20)11-15)19-5-4-8-24(19)14-22(26)6-2-1-3-7-22/h15-20,26H,1-14H2,(H,23,25)/t15?,16?,17?,18?,19-,20?/m1/s1
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| InChIKey |
KHFNNINHZIFWSS-RDOIFFKNSA-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