General Information of the Compound
| Compound ID |
CP0907730
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| Compound Name |
(S)-3-(3-Dimethylamino-propyl)-5-phenethyl-1-[2'-(2H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-imidazolidine-2,4-dione
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| Structure |
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| Formula |
C30H33N7O2
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| Molecular Weight |
523.641
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| Canonical SMILES |
CN(C)CCCN1C(=O)[C@H](CCc2ccccc2)N(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)C1=O
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| InChI |
InChI=1S/C30H33N7O2/c1-35(2)19-8-20-36-29(38)27(18-15-22-9-4-3-5-10-22)37(30(36)39)21-23-13-16-24(17-14-23)25-11-6-7-12-26(25)28-31-33-34-32-28/h3-7,9-14,16-17,27H,8,15,18-21H2,1-2H3,(H,31,32,33,34)/t27-/m0/s1
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| InChIKey |
IXLOJUPQFLFPAG-MHZLTWQESA-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