General Information of the Compound
| Compound ID |
CP0559572
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| Compound Name |
(R)-N-(4-(piperidin-1-ylmethyl)phenethyl)-3-(naphthalene-7-sulfonamido)-3-phenylpropanamide
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| Structure |
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| Formula |
C33H37N3O3S
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| Molecular Weight |
555.744
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| Canonical SMILES |
O=C(C[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)c1ccccc1)NCCc1ccc(CN2CCCCC2)cc1
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| InChI |
InChI=1S/C33H37N3O3S/c37-33(34-20-19-26-13-15-27(16-14-26)25-36-21-7-2-8-22-36)24-32(29-10-3-1-4-11-29)35-40(38,39)31-18-17-28-9-5-6-12-30(28)23-31/h1,3-6,9-18,23,32,35H,2,7-8,19-22,24-25H2,(H,34,37)/t32-/m1/s1
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| InChIKey |
NRNMREPCSKVNAK-JGCGQSQUSA-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