General Information of the Compound
| Compound ID |
CP0436486
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| Compound Name |
4-[[(3S)-1-cyclopropylpiperidin-3-yl]methyl]-N-phenylpiperazine-1-carboxamide
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| Structure |
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| Formula |
C20H30N4O
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| Molecular Weight |
342.487
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| Canonical SMILES |
O=C(Nc1ccccc1)N1CCN(C[C@@H]2CCCN(C2)C2CC2)CC1
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| InChI |
InChI=1S/C20H30N4O/c25-20(21-18-6-2-1-3-7-18)23-13-11-22(12-14-23)15-17-5-4-10-24(16-17)19-8-9-19/h1-3,6-7,17,19H,4-5,8-16H2,(H,21,25)/t17-/m0/s1
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| InChIKey |
RLKNKLPRFIBHAS-KRWDZBQOSA-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