COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK704388
Chemical Name: 4-[(3,4-dimethoxyphenyl)carbonyl]-3-hydroxy-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-[4-(pentyloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCCOc1ccc(cc1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=C1C(=O)c1ccc(c(c1)OC)OC)O

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Molecular Weight: 681.83
Empirical Formula: C37H35N3O6S2

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 9.402
Rotatable bonds: 12
H-donors: 1
H-acceptors: 6
PSA: 164
Number of rings: 6

     

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