General Information of the Compound
| Compound ID |
CP0357139
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| Compound Name |
4-((1-(benzo[d][1,3]dioxol-5-ylmethyl)piperidin-4-yl)methyl)-N-(cyclopropylmethyl)benzamide
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| Structure |
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| Formula |
C25H30N2O3
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| Molecular Weight |
406.526
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| Canonical SMILES |
O=C(NCC1CC1)c1ccc(CC2CCN(Cc3ccc4OCOc4c3)CC2)cc1
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| InChI |
InChI=1S/C25H30N2O3/c28-25(26-15-20-1-2-20)22-6-3-18(4-7-22)13-19-9-11-27(12-10-19)16-21-5-8-23-24(14-21)30-17-29-23/h3-8,14,19-20H,1-2,9-13,15-17H2,(H,26,28)
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| InChIKey |
YASHLRFPXFLHSZ-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