COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK087573
Chemical Name: 2-(2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)-1H-isoindole-1,3(2H)-dione
Smiles: O=C(N1CCN(CC1)c1ccccc1)CSc1nc2c(s1)cc(cc2)N1C(=O)c2c(C1=O)cccc2

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Molecular Weight: 514.63
Empirical Formula: C27H22N4O3S2

Physical State: Dry powder
Available Amount: 385 mg

Lipinsky:
logP: 4.133
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 127
Number of rings: 6

     

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