General Information of the Compound
| Compound ID |
CP0961789
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| Compound Name |
1-(4-fluorophenyl)-N-(2-methoxyethyl)-2-(4-(pyrazin-2-yl)piperazin-1-yl)ethanamine
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| Structure |
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| Formula |
C19H26FN5O
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| Molecular Weight |
359.449
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| Canonical SMILES |
COCCNC(CN1CCN(c2cnccn2)CC1)c1ccc(F)cc1
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| InChI |
InChI=1S/C19H26FN5O/c1-26-13-8-22-18(16-2-4-17(20)5-3-16)15-24-9-11-25(12-10-24)19-14-21-6-7-23-19/h2-7,14,18,22H,8-13,15H2,1H3
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| InChIKey |
PDTZYFPRVYJYQH-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