General Information of the Compound
| Compound ID |
CP0870477
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| Compound Name |
(S)-N-(2-amino-1-(5-(hydroxymethyl)thiazol-2-yl)ethyl)-5-cyclohexyl-1H-pyrrole-2-carboxamide
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| Formula |
C17H24N4O2S
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| Molecular Weight |
348.472
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| Canonical SMILES |
NC[C@H](NC(=O)c1ccc(C2CCCCC2)[nH]1)c1ncc(CO)s1
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| InChI |
InChI=1S/C17H24N4O2S/c18-8-15(17-19-9-12(10-22)24-17)21-16(23)14-7-6-13(20-14)11-4-2-1-3-5-11/h6-7,9,11,15,20,22H,1-5,8,10,18H2,(H,21,23)/t15-/m0/s1
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| InChIKey |
UVMCBLXCHBWNLO-HNNXBMFYSA-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