General Information of the Compound
| Compound ID |
CP0376476
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| Compound Name |
1-[[6-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-2-yl]methyl]-1-(4-methoxyphenyl)urea
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| Structure |
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| Formula |
C25H35N3O2
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| Molecular Weight |
409.574
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| Canonical SMILES |
CCCN(CCC)C1CCc2cc(CN(C(N)=O)c3ccc(OC)cc3)ccc2C1
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| InChI |
InChI=1S/C25H35N3O2/c1-4-14-27(15-5-2)23-9-8-20-16-19(6-7-21(20)17-23)18-28(25(26)29)22-10-12-24(30-3)13-11-22/h6-7,10-13,16,23H,4-5,8-9,14-15,17-18H2,1-3H3,(H2,26,29)
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| InChIKey |
AGQAAIRBRCRFGB-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: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor