General Information of the Compound
| Compound ID |
CP0579679
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| Compound Name |
N-(cis-1-acetyl-2-(((cis-4- methylcyclohexyl)oxy)methyl)- piperidin-3-yl)methanesulfonamide
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| Formula |
C16H30N2O4S
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| Molecular Weight |
346.493
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| Canonical SMILES |
C[C@H]1CC[C@H](CC1)OC[C@H]1[C@H](CCCN1C(C)=O)NS(C)(=O)=O
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| InChI |
InChI=1S/C16H30N2O4S/c1-12-6-8-14(9-7-12)22-11-16-15(17-23(3,20)21)5-4-10-18(16)13(2)19/h12,14-17H,4-11H2,1-3H3/t12-,14+,15-,16-/m0/s1
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| InChIKey |
IABNEMZFAGHVLK-UKMLZYKCSA-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
Protein ID: PT01132, Orexin receptor type 2
Protein ID: PT02001, Orexin/Hypocretin receptor type 1