General Information of the Compound
| Compound ID |
CP0393465
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| Compound Name |
N-[2-(morpholin-4-ylmethyl)phenyl]-3,5-bis[(2-piperidin-1-ylethylamino)methyl]aniline
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| Structure |
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| Formula |
C33H52N6O
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| Molecular Weight |
548.82
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| Canonical SMILES |
C(CN1CCCCC1)NCc1cc(CNCCN2CCCCC2)cc(Nc2ccccc2CN2CCOCC2)c1
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| InChI |
InChI=1S/C33H52N6O/c1-5-13-37(14-6-1)17-11-34-26-29-23-30(27-35-12-18-38-15-7-2-8-16-38)25-32(24-29)36-33-10-4-3-9-31(33)28-39-19-21-40-22-20-39/h3-4,9-10,23-25,34-36H,1-2,5-8,11-22,26-28H2
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| InChIKey |
PAFMRDKEWWXTBK-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