General Information of the Compound
| Compound ID |
CP0393245
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| Compound Name |
N-(diaminomethylidene)-4-phenylpiperazine-1-carboximidamide
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| Structure |
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| Formula |
C12H18N6
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| Molecular Weight |
246.318
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| Canonical SMILES |
NC(=N)NC(=N)N1CCN(CC1)c1ccccc1
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| InChI |
InChI=1S/C12H18N6/c13-11(14)16-12(15)18-8-6-17(7-9-18)10-4-2-1-3-5-10/h1-5H,6-9H2,(H5,13,14,15,16)
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| InChIKey |
LQWASOLNMNSTSB-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
Protein ID: PT04763, Trace amine-associated receptor 1
Protein ID: PT03226, Trace amine-associated receptor 1
Protein ID: PT06391, Trace amine-associated receptor 5