General Information of the Compound
| Compound ID |
CP0361354
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| Compound Name |
4-benzyl-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
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| Structure |
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| Formula |
C16H21N5
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| Molecular Weight |
283.379
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| Canonical SMILES |
CN[C@@H]1CCN(C1)c1cc(Cc2ccccc2)nc(N)n1
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| InChI |
InChI=1S/C16H21N5/c1-18-13-7-8-21(11-13)15-10-14(19-16(17)20-15)9-12-5-3-2-4-6-12/h2-6,10,13,18H,7-9,11H2,1H3,(H2,17,19,20)/t13-/m1/s1
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| InChIKey |
QYMGHIAMJHEVHC-CYBMUJFWSA-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