General Information of the Compound
| Compound ID |
CP0439580
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| Compound Name |
(S)-N6,N6-dimethyl-N4-(1-phenylethyl)pyrido[3,4-d]pyrimidine-4,6-diamine
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| Structure |
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| Formula |
C17H19N5
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| Molecular Weight |
293.374
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| Canonical SMILES |
C[C@H](Nc1ncnc2cnc(cc12)N(C)C)c1ccccc1
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| InChI |
InChI=1S/C17H19N5/c1-12(13-7-5-4-6-8-13)21-17-14-9-16(22(2)3)18-10-15(14)19-11-20-17/h4-12H,1-3H3,(H,19,20,21)/t12-/m0/s1
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| InChIKey |
UHPWLWZLBWNVGP-LBPRGKRZSA-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