COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473414
Chemical Name: propan-2-yl2-{[(2E)-3-(5-bromothiophen-2-yl)-2-cyanoprop-2-enoyl]amino}thiophene-3-carboxylate
Smiles: N#C/C(=C\c1ccc(s1)Br)/C(=O)Nc1sccc1C(=O)OC(C)C

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Molecular Weight: 425.33
Empirical Formula: C16H13BrN2O3S2

Physical State: Dry powder
Available Amount: 297 mg

Lipinsky:
logP: 6.402
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 135
Number of rings: 2

     

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