COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK573493
Chemical Name: 5-{[(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)/N=C/1\SC2C(N1Cc1ccc3c(c1)OCO3)CS(=O)(=O)C2

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Molecular Weight: 440.5
Empirical Formula: C18H20N2O7S2

Physical State: Dry powder
Available Amount: 320 mg

Lipinsky:
logP: 0.08
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 156
Number of rings: 4

     

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