General Information of the Compound
| Compound ID |
CP0176059
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| Compound Name |
4-[[[5-[(3R)-3-aminopiperidin-1-yl]pyrazolo[1,5-a]pyrimidin-7-yl]amino]methyl]phenol
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| Formula |
C18H22N6O
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| Molecular Weight |
338.415
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| Canonical SMILES |
N[C@@H]1CCCN(C1)c1cc(NCc2ccc(O)cc2)n2nccc2n1
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| InChI |
InChI=1S/C18H22N6O/c19-14-2-1-9-23(12-14)18-10-17(24-16(22-18)7-8-21-24)20-11-13-3-5-15(25)6-4-13/h3-8,10,14,20,25H,1-2,9,11-12,19H2/t14-/m1/s1
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| InChIKey |
OTVOXJUZKRMGNY-CQSZACIVSA-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