General Information of the Compound
| Compound ID |
CP0384170
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| Compound Name |
1-(1-Benzyl-piperidin-4-yl)-3-[3-(4-benzyl-piperidin-1-ylmethyl)-phenyl]-urea
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| Structure |
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| Formula |
C32H40N4O
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| Molecular Weight |
496.699
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| Canonical SMILES |
O=C(NC1CCN(Cc2ccccc2)CC1)Nc1cccc(CN2CCC(Cc3ccccc3)CC2)c1
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| InChI |
InChI=1S/C32H40N4O/c37-32(33-30-16-20-36(21-17-30)24-28-10-5-2-6-11-28)34-31-13-7-12-29(23-31)25-35-18-14-27(15-19-35)22-26-8-3-1-4-9-26/h1-13,23,27,30H,14-22,24-25H2,(H2,33,34,37)
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| InChIKey |
QACIWFUOGVFMLP-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