General Information of the Compound
| Compound ID |
CP0484881
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| Compound Name |
N-methyl-N-(thiophen-3-ylmethyl)adamantane-1-carboxamide
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| Structure |
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| Formula |
C17H23NOS
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| Molecular Weight |
289.444
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| Canonical SMILES |
CN(Cc1ccsc1)C(=O)C12CC3CC(CC(C3)C1)C2
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| InChI |
InChI=1S/C17H23NOS/c1-18(10-12-2-3-20-11-12)16(19)17-7-13-4-14(8-17)6-15(5-13)9-17/h2-3,11,13-15H,4-10H2,1H3
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| InChIKey |
KYAFPEIUNVEVBY-UHFFFAOYSA-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