General Information of the Compound
| Compound ID |
CP0087267
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| Compound Name |
3-(1H-imidazol-5-yl)propyl N-[2-(2-chlorophenoxy)ethyl]carbamate
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| Structure |
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| Formula |
C15H18ClN3O3
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| Molecular Weight |
323.78
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| Canonical SMILES |
Clc1ccccc1OCCNC(=O)OCCCc1c[nH]cn1
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| InChI |
InChI=1S/C15H18ClN3O3/c16-13-5-1-2-6-14(13)21-9-7-18-15(20)22-8-3-4-12-10-17-11-19-12/h1-2,5-6,10-11H,3-4,7-9H2,(H,17,19)(H,18,20)
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| InChIKey |
MTCUDJGTLHSVNC-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
Protein ID: PT01194, Histamine H3 receptor
Protein ID: PT01711, Histamine H4 receptor