General Information of the Compound
| Compound ID |
CP0360374
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| Compound Name |
2-[cyclopropylmethyl(propyl)amino]-N-[(2S)-1-(3,5-difluorophenyl)-3-hydroxypropan-2-yl]-6-[methyl(propan-2-ylsulfonyl)amino]pyridine-4-carboxamide
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| Structure |
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| Formula |
C26H36F2N4O4S
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| Molecular Weight |
538.661
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| Canonical SMILES |
CCCN(CC1CC1)c1cc(cc(n1)N(C)S(=O)(=O)C(C)C)C(=O)N[C@H](CO)Cc1cc(F)cc(F)c1
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| InChI |
InChI=1S/C26H36F2N4O4S/c1-5-8-32(15-18-6-7-18)25-13-20(12-24(30-25)31(4)37(35,36)17(2)3)26(34)29-23(16-33)11-19-9-21(27)14-22(28)10-19/h9-10,12-14,17-18,23,33H,5-8,11,15-16H2,1-4H3,(H,29,34)/t23-/m0/s1
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| InChIKey |
IKGRUPPYIQOVJN-QHCPKHFHSA-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