General Information of the Compound
| Compound ID |
CP0528006
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| Compound Name |
N-methyl-N-[(3R)-1-propan-2-ylpyrrolidin-3-yl]-4-(pyrazol-1-ylmethyl)benzamide
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| Structure |
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| Formula |
C19H26N4O
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| Molecular Weight |
326.444
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| Canonical SMILES |
CC(C)N1CC[C@H](C1)N(C)C(=O)c1ccc(Cn2cccn2)cc1
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| InChI |
InChI=1S/C19H26N4O/c1-15(2)22-12-9-18(14-22)21(3)19(24)17-7-5-16(6-8-17)13-23-11-4-10-20-23/h4-8,10-11,15,18H,9,12-14H2,1-3H3/t18-/m1/s1
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| InChIKey |
RUNQEQMRPYBUDW-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