General Information of the Compound
| Compound ID |
CP0401430
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| Compound Name |
4-tert-Butylphenyl-(1R,2S,5R)-2-isopropyl-5-methylcyclohexylcarbamate
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| Structure |
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| Formula |
C21H33NO2
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| Molecular Weight |
331.5
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| Canonical SMILES |
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1NC(=O)Oc1ccc(cc1)C(C)(C)C
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| InChI |
InChI=1S/C21H33NO2/c1-14(2)18-12-7-15(3)13-19(18)22-20(23)24-17-10-8-16(9-11-17)21(4,5)6/h8-11,14-15,18-19H,7,12-13H2,1-6H3,(H,22,23)/t15-,18+,19-/m1/s1
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| InChIKey |
NYAAVALHCMHJEL-AYOQOUSVSA-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: PT02148, Transient receptor potential cation channel subfamily A member 1
Protein ID: PT05529, Transient receptor potential cation channel subfamily M member 8
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1