General Information of the Compound
| Compound ID |
CP0491818
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| Compound Name |
(R)-1-cyclopropyl-3-(3-(methylamino)-1-phenylpropyl)-1H-benzo[d]imidazol-2(3H)-one
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| Structure |
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| Formula |
C20H23N3O
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| Molecular Weight |
321.424
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| Canonical SMILES |
CNCC[C@H](c1ccccc1)n1c2ccccc2n(C2CC2)c1=O
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| InChI |
InChI=1S/C20H23N3O/c1-21-14-13-17(15-7-3-2-4-8-15)23-19-10-6-5-9-18(19)22(20(23)24)16-11-12-16/h2-10,16-17,21H,11-14H2,1H3/t17-/m1/s1
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| InChIKey |
LXKDYSGDYBBTJV-QGZVFWFLSA-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: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter