General Information of the Compound
| Compound ID |
CP0372322
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| Compound Name |
2-(3-(2-((R)-2-methylpyrrolidin-1-yl)ethyl)-1-(2-((S)-2-methylpyrrolidin-1-yl)ethyl)imidazolidin-2-ylidene)malononitrile
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| Structure |
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| Formula |
C20H32N6
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| Molecular Weight |
356.518
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| Canonical SMILES |
C[C@H]1CCCN1CCN1CCN(CCN2CCC[C@H]2C)C1=C(C#N)C#N
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| InChI |
InChI=1S/C20H32N6/c1-17-5-3-7-23(17)9-11-25-13-14-26(20(25)19(15-21)16-22)12-10-24-8-4-6-18(24)2/h17-18H,3-14H2,1-2H3/t17-,18+
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| InChIKey |
HLHVJNKYUMTXDA-HDICACEKSA-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