General Information of the Compound
| Compound ID |
CP0146486
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| Compound Name |
(4R)-N'-methyl-N'-[(4-methylbenzene)sulfonyl]-1-(naphthalene-2-sulfonyl)-4-sulfanylpyrrolidine-2-carbohydrazide
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| Structure |
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| Formula |
C23H25N3O5S3
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| Molecular Weight |
519.67
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| Canonical SMILES |
CN(NC(=O)C1C[C@@H](S)CN1S(=O)(=O)c1ccc2ccccc2c1)S(=O)(=O)c1ccc(C)cc1
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| InChI |
InChI=1S/C23H25N3O5S3/c1-16-7-10-20(11-8-16)33(28,29)25(2)24-23(27)22-14-19(32)15-26(22)34(30,31)21-12-9-17-5-3-4-6-18(17)13-21/h3-13,19,22,32H,14-15H2,1-2H3,(H,24,27)/t19-,22?/m1/s1
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| InChIKey |
FJCTWYALBIKBLC-LCQOSCCDSA-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