General Information of the Compound
| Compound ID |
CP0388670
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| Compound Name |
N-[[(1S,2S)-2-phenylcyclopropyl]methyl]propan-2-amine
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| Structure |
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| Formula |
C13H19N
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| Molecular Weight |
189.302
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| Canonical SMILES |
CC(C)NC[C@H]1C[C@@H]1c1ccccc1
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| InChI |
InChI=1S/C13H19N/c1-10(2)14-9-12-8-13(12)11-6-4-3-5-7-11/h3-7,10,12-14H,8-9H2,1-2H3/t12-,13-/m1/s1
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| InChIKey |
ZQEPDMZYCDQAFT-CHWSQXEVSA-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