General Information of the Compound
| Compound ID |
CP0687911
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| Compound Name |
2-(4-{[2-(2-Methoxyphenoxy)ethyl]amino}butyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione hydrochloride
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| Structure |
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| Formula |
C19H28ClN3O4
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| Molecular Weight |
397.903
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| Canonical SMILES |
COc1ccccc1OCCNCCCCN1C(=O)C2CCCN2C1=O.Cl
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| InChI |
InChI=1S/C19H27N3O4.ClH/c1-25-16-8-2-3-9-17(16)26-14-11-20-10-4-5-12-22-18(23)15-7-6-13-21(15)19(22)24;/h2-3,8-9,15,20H,4-7,10-14H2,1H3;1H
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| InChIKey |
CAAIELWTMXFJLF-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