General Information of the Compound
| Compound ID |
CP0404534
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| Compound Name |
N-[(2R)-3-(7-methyl-1H-indazol-5-yl)-1-oxo-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-yl]-4-(4-methylphenyl)piperidine-1-carboxamide
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| Structure |
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| Formula |
C34H46N6O2
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| Molecular Weight |
570.782
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| Canonical SMILES |
Cc1ccc(cc1)C1CCN(CC1)C(=O)N[C@H](Cc1cc(C)c2[nH]ncc2c1)C(=O)N1CCC(CC1)N1CCCCC1
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| InChI |
InChI=1S/C34H46N6O2/c1-24-6-8-27(9-7-24)28-10-16-40(17-11-28)34(42)36-31(22-26-20-25(2)32-29(21-26)23-35-37-32)33(41)39-18-12-30(13-19-39)38-14-4-3-5-15-38/h6-9,20-21,23,28,30-31H,3-5,10-19,22H2,1-2H3,(H,35,37)(H,36,42)/t31-/m1/s1
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| InChIKey |
RXIIQYXCMYPPHU-WJOKGBTCSA-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