General Information of the Compound
| Compound ID |
CP0511682
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| Compound Name |
2-(Adamantan-2-ylcarbamoyl)-thiazolidine-3-carboxylic acid tert-butyl ester
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| Structure |
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| Formula |
C19H30N2O3S
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| Molecular Weight |
366.527
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| Canonical SMILES |
CC(C)(C)OC(=O)N1CCSC1C(=O)NC1C2CC3CC(C2)CC1C3
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| InChI |
InChI=1S/C19H30N2O3S/c1-19(2,3)24-18(23)21-4-5-25-17(21)16(22)20-15-13-7-11-6-12(9-13)10-14(15)8-11/h11-15,17H,4-10H2,1-3H3,(H,20,22)
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| InChIKey |
WNYCNDJJJGUDIK-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