COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK704338
Chemical Name: 4-[(3,4-dimethoxyphenyl)carbonyl]-3-hydroxy-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(3,4,5-trimethoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(cc(c1OC)OC)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=C1C(=O)c1ccc(c(c1)OC)OC)O

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Molecular Weight: 685.78
Empirical Formula: C35H31N3O8S2

Physical State: Dry powder
Available Amount: 109 mg

Lipinsky:
logP: 6.8
Rotatable bonds: 10
H-donors: 1
H-acceptors: 8
PSA: 183
Number of rings: 6

     

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