General Information of the Compound
| Compound ID |
CP0521649
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| Compound Name |
(5-chloro-7-fluoro-1H-indol-2-yl)-[(3R)-3-(methylamino)pyrrolidin-1-yl]methanone
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| Structure |
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| Formula |
C14H15ClFN3O
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| Molecular Weight |
295.745
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| Canonical SMILES |
CN[C@@H]1CCN(C1)C(=O)c1cc2cc(Cl)cc(F)c2[nH]1
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| InChI |
InChI=1S/C14H15ClFN3O/c1-17-10-2-3-19(7-10)14(20)12-5-8-4-9(15)6-11(16)13(8)18-12/h4-6,10,17-18H,2-3,7H2,1H3/t10-/m1/s1
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| InChIKey |
PKDHDUKNDAOZMB-SNVBAGLBSA-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