General Information of the Compound
| Compound ID |
CP0886599
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| Compound Name |
Phenyl-[1-phenyl-imidazolidin-(2E)-ylidene]-amine; compound with methanesulfonic acid
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| Structure |
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| Formula |
C16H19N3O3S
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| Molecular Weight |
333.413
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| Canonical SMILES |
CS(=O)(=O)O.c1ccc(NC2=NCCN2c2ccccc2)cc1
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| InChI |
InChI=1S/C15H15N3.CH4O3S/c1-3-7-13(8-4-1)17-15-16-11-12-18(15)14-9-5-2-6-10-14;1-5(2,3)4/h1-10H,11-12H2,(H,16,17);1H3,(H,2,3,4)
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| InChIKey |
VLNZIJSXFCDARL-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