Drug Details |  |
Name: | alpha-ketothiazole analogue 13 |  |
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PubChem ID: | 23646328 |
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Pathway: | Show KEGG pathways |
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InChI: | InChI=1S/C29H37N7O4S2/c1-18(2)24(27(40)35-21(11-6-12-33-29(30)31)25(38)28-32-13-15-42-28)36-26(39)22(16-19-8-4-3-5-9-19)34-23(37)17-20-10-7-14-41-20/h3-5,7-10,13-15,18,21-22,24H,6,11-12,16-17H2,1-2H3,(H,34,37)(H,35,40)(H,36,39)(H4,30,31,33)/t21-,22-,24-/m0/s1 |
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SMILES: | O=C(N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)c1nccs1)CCCN=C(N)N)C(C)C)Cc1ccccc1)Cc1cccs1 |
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Properties: | Formula: | C29H37N7O4S2 | Atoms: | 42 |
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Molecular Weight: | 611.779 | Rotatable Bonds: | 19 |
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H-bond Acceptors: | 13 | H-bond Donors: | 5 |
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logP: | 4.61 | | |
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Targets: | |
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Synonyms: | ()-oxazepam hemisuccinate sodium salt | alpha-ketothiazole analogue 13 |
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