General Information of the Compound
| Compound ID |
CP0397243
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| Compound Name |
3-(1H-imidazol-5-yl)propyl N-(3-phenoxypropyl)carbamate
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| Structure |
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| Formula |
C16H21N3O3
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| Molecular Weight |
303.362
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| Canonical SMILES |
O=C(NCCCOc1ccccc1)OCCCc1c[nH]cn1
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| InChI |
InChI=1S/C16H21N3O3/c20-16(22-10-4-6-14-12-17-13-19-14)18-9-5-11-21-15-7-2-1-3-8-15/h1-3,7-8,12-13H,4-6,9-11H2,(H,17,19)(H,18,20)
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| InChIKey |
WZUATPVPGCCNQR-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