General Information of the Compound
| Compound ID |
CP0568360
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| Compound Name |
(2R,3S)-2,3-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-5-carboxamide
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| Structure |
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| Formula |
C10H13N3O
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| Molecular Weight |
191.234
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| Canonical SMILES |
C[C@H]1Nc2ncc(cc2[C@@H]1C)C(N)=O
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| InChI |
InChI=1S/C10H13N3O/c1-5-6(2)13-10-8(5)3-7(4-12-10)9(11)14/h3-6H,1-2H3,(H2,11,14)(H,12,13)/t5-,6-/m1/s1
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| InChIKey |
VOSBZPWKFAZMLN-PHDIDXHHSA-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