General Information of the Compound
| Compound ID |
CP0487974
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| Compound Name |
(2S)-3-[[(1S,2S)-2-[ethyl(propyl)amino]-1,2-dipyridin-2-ylethyl]-(2-methoxyethyl)amino]-2-methylpropan-1-ol
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| Structure |
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| Formula |
C24H38N4O2
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| Molecular Weight |
414.594
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| Canonical SMILES |
CCCN(CC)[C@@H]([C@H](N(CCOC)C[C@H](C)CO)c1ccccn1)c1ccccn1
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| InChI |
InChI=1S/C24H38N4O2/c1-5-15-27(6-2)23(21-11-7-9-13-25-21)24(22-12-8-10-14-26-22)28(16-17-30-4)18-20(3)19-29/h7-14,20,23-24,29H,5-6,15-19H2,1-4H3/t20-,23+,24+/m0/s1
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| InChIKey |
VOVVOYNEQIHWDR-TUACAJSNSA-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