General Information of the Compound
| Compound ID |
CP0550883
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| Compound Name |
5-[(3aS,6aR)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl]-2-phenylmethoxy-N-pyridazin-4-ylbenzamide
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| Structure |
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| Formula |
C24H24N4O3
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| Molecular Weight |
416.481
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| Canonical SMILES |
O=C(Nc1ccnnc1)c1cc(ccc1OCc1ccccc1)N1C[C@@H]2COC[C@@H]2C1
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| InChI |
InChI=1S/C24H24N4O3/c29-24(27-20-8-9-25-26-11-20)22-10-21(28-12-18-15-30-16-19(18)13-28)6-7-23(22)31-14-17-4-2-1-3-5-17/h1-11,18-19H,12-16H2,(H,25,27,29)/t18-,19+
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| InChIKey |
QFWJTAWHWVJZRW-KDURUIRLSA-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