COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK691157
Chemical Name: methyl2-[bis(2-methylpropoxy)phosphoryl]-N-(6-chloro-1,3-benzothiazol-2-yl)-3,3,3-trifluoroalaninate
Smiles: COC(=O)C(P(=O)(OCC(C)C)OCC(C)C)(C(F)(F)F)Nc1nc2c(s1)cc(cc2)Cl

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Molecular Weight: 516.91
Empirical Formula: C19H25ClF3N2O5PS

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 9.706
Rotatable bonds: 10
H-donors: 1
H-acceptors: 5
PSA: 124
Number of rings: 2

     

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