General Information of the Compound
| Compound ID |
CP0501951
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| Compound Name |
3-[4-[2-(dimethylamino)ethyl]phenoxy]-N,N-dimethylpropan-1-amine
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| Synonyms |
3-[4-[2-(Dimethylamino)ethyl]phenoxy-2,6-D2]-N,N-dimethyl-1-propanamine
BDBM50177732
CHEMBL204377
Des-bromoaplysamine-1
MFCD30297079 (95%)
SY246342
des-bromoaplysamine-1
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| Structure |
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| Formula |
C15H26N2O
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| Molecular Weight |
250.386
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| Canonical SMILES |
CN(C)CCCOc1ccc(CCN(C)C)cc1
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| InChI |
InChI=1S/C15H26N2O/c1-16(2)11-5-13-18-15-8-6-14(7-9-15)10-12-17(3)4/h6-9H,5,10-13H2,1-4H3
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| InChIKey |
DXZMBOOTLSIFGN-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
Clinical Information about the Compound