COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK683933
Chemical Name: 1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-7,7-dimethyl-4-(4-nitrophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: O=C1CC(c2ccc(cc2)[N+](=O)[O-])C2=C(N1c1nnc(s1)SCc1ccccc1Cl)CC(CC2=O)(C)C

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Molecular Weight: 555.08
Empirical Formula: C26H23ClN4O4S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.212
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 162
Number of rings: 5

     

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