General Information of the Compound
| Compound ID |
CP0861813
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| Compound Name |
(R)-7-cyclopropyl-4-(3-(methylamino)pyrrolidin-1-yl)quinazolin-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(c2nc(N)nc3cc(C4CC4)ccc23)C1
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| InChI |
InChI=1S/C16H21N5/c1-18-12-6-7-21(9-12)15-13-5-4-11(10-2-3-10)8-14(13)19-16(17)20-15/h4-5,8,10,12,18H,2-3,6-7,9H2,1H3,(H2,17,19,20)/t12-/m1/s1
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| InChIKey |
PLSSBUTVCXDGTH-GFCCVEGCSA-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: PT01194, Histamine H3 receptor
Protein ID: PT01711, Histamine H4 receptor