General Information of the Compound
| Compound ID |
CP0836441
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| Compound Name |
(R)-3-Phenyl-3-((6-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)propan-1-ol
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| Formula |
C21H20N4O
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| Molecular Weight |
344.418
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| Canonical SMILES |
OCC[C@@H](Nc1ncnc2[nH]c(-c3ccccc3)cc12)c1ccccc1
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| InChI |
InChI=1S/C21H20N4O/c26-12-11-18(15-7-3-1-4-8-15)24-20-17-13-19(16-9-5-2-6-10-16)25-21(17)23-14-22-20/h1-10,13-14,18,26H,11-12H2,(H2,22,23,24,25)/t18-/m1/s1
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| InChIKey |
VFWLWDWLLFXUHQ-GOSISDBHSA-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