COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK853085
Chemical Name: methyl3-{[(2Z)-4-(2-ethoxy-2-oxoethyl)-1,3-thiazol-2(3H)-ylidene]carbamoyl}-5-nitrobenzoate
Smiles: CCOC(=O)Cc1cs/c(=N\C(=O)c2cc(cc(c2)C(=O)OC)[N+](=O)[O-])/[nH]1

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Molecular Weight: 393.38
Empirical Formula: C16H15N3O7S

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 3.364
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 165
Number of rings: 2

     

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