COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK677366
Chemical Name: 2-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-nitro-1H-isoindole-1,3(2H)-dione
Smiles: O=C(N1CCc2c1cccc2)CSc1nc2c(s1)cc(cc2)N1C(=O)c2c(C1=O)cccc2[N+](=O)[O-]

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Molecular Weight: 516.56
Empirical Formula: C25H16N4O5S2

Available Amount: 0 mg

Lipinsky:
logP: 4.7
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 169
Number of rings: 6

     

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