General Information of the Compound
| Compound ID |
CP0375577
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| Compound Name |
10-methyl-17,19-dioxa-10-azatetracyclo[12.7.0.0^{2,7}.0^{16,20}]henicosa-1(14),2(7),3,5,15,20-hexaene
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| Structure |
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| Formula |
C19H21NO2
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| Molecular Weight |
295.382
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| Canonical SMILES |
CN1CCCc2cc3OCOc3cc2-c2ccccc2CC1
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| InChI |
InChI=1S/C19H21NO2/c1-20-9-4-6-15-11-18-19(22-13-21-18)12-17(15)16-7-3-2-5-14(16)8-10-20/h2-3,5,7,11-12H,4,6,8-10,13H2,1H3
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| InChIKey |
IPSSDOFRDHFANX-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
Protein ID: PT01161, D(4) dopamine receptor