General Information of the Compound
| Compound ID |
CP0414670
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| Compound Name |
N-[(4-chlorophenyl)methyl]-1-[2-(3,5-dimethylphenyl)acetyl]-2-methyl-N-(2-morpholin-4-yl-2-oxoethyl)azetidine-2-carboxamide
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| Structure |
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| Formula |
C28H34ClN3O4
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| Molecular Weight |
512.05
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| Canonical SMILES |
Cc1cc(C)cc(CC(=O)N2CCC2(C)C(=O)N(CC(=O)N2CCOCC2)Cc2ccc(Cl)cc2)c1
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| InChI |
InChI=1S/C28H34ClN3O4/c1-20-14-21(2)16-23(15-20)17-25(33)32-9-8-28(32,3)27(35)31(18-22-4-6-24(29)7-5-22)19-26(34)30-10-12-36-13-11-30/h4-7,14-16H,8-13,17-19H2,1-3H3
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| InChIKey |
MLDFIPPSVHQBPV-UHFFFAOYSA-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