General Information of the Compound
| Compound ID |
CP0056798
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| Compound Name |
(S)-1-(5,6-difluoro-1H-indol-1-yl)propan-2-amine
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| Synonyms |
(S)-1-(5,6-Difluoro-1H-indol-1-yl)-2-propanamine
(S)-1-(5,6-difluoro-1H-indol-1-yl)propan-2-amine
BDBM50108306
CHEMBL40726
SCHEMBL8959516
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| Structure |
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| Formula |
C11H12F2N2
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| Molecular Weight |
210.227
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| Canonical SMILES |
C[C@H](N)Cn1ccc2cc(F)c(F)cc12
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| InChI |
InChI=1S/C11H12F2N2/c1-7(14)6-15-3-2-8-4-9(12)10(13)5-11(8)15/h2-5,7H,6,14H2,1H3/t7-/m0/s1
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| InChIKey |
MYZDBEVPJGKIQS-ZETCQYMHSA-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
Clinical Information about the Compound