General Information of the Compound
| Compound ID |
CP0385996
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| Compound Name |
(+/-)-1-[2-biphenyl-4-yl-2-(4-methylpiperazin-1-yl)ethyl]-4-[4-(1-naphthyl)butyl]piperazine
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| Structure |
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| Formula |
C37H46N4
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| Molecular Weight |
546.803
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| Canonical SMILES |
CN1CCN(CC1)C(CN1CCN(CCCCc2cccc3ccccc23)CC1)c1ccc(cc1)-c1ccccc1
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| InChI |
InChI=1S/C37H46N4/c1-38-22-28-41(29-23-38)37(35-19-17-32(18-20-35)31-10-3-2-4-11-31)30-40-26-24-39(25-27-40)21-8-7-13-34-15-9-14-33-12-5-6-16-36(33)34/h2-6,9-12,14-20,37H,7-8,13,21-30H2,1H3
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| InChIKey |
FBNHMHGIMMCLHO-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