General Information of the Compound
| Compound ID |
CP0510086
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| Compound Name |
Bis(N-propylnoraporphin-11-O-yl) glutamate
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| Structure |
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| Formula |
C43H46N2O4
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| Molecular Weight |
654.851
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| Canonical SMILES |
CCCN1CCc2cccc3-c4cc(OC(=O)CCCC(=O)Oc5cccc6C[C@H]7N(CCC)CCc8cccc(c78)-c56)ccc4C[C@@H]1c23
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| InChI |
InChI=1S/C43H46N2O4/c1-3-21-44-23-19-28-9-5-12-33-35-27-32(18-17-30(35)25-36(44)41(28)33)48-39(46)15-8-16-40(47)49-38-14-7-11-31-26-37-42-29(20-24-45(37)22-4-2)10-6-13-34(42)43(31)38/h5-7,9-14,17-18,27,36-37H,3-4,8,15-16,19-26H2,1-2H3/t36-,37-/m1/s1
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| InChIKey |
MFYPDFYITWHTII-FZNHDDJXSA-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: PT01448, 5-hydroxytryptamine receptor 1A
Protein ID: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT01005, D(2) dopamine receptor