COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK008207
Chemical Name: 3-{(Z)-[1-(4-bromophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}phenylthiophene-2-carboxylate
Smiles: Brc1ccc(cc1)N1NC(=O)/C(=C/c2cccc(c2)OC(=O)c2cccs2)/C1=O

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Molecular Weight: 469.32
Empirical Formula: C21H13BrN2O4S

Physical State: Dry powder
Available Amount: 111 mg

Lipinsky:
logP: 4.92
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 103
Number of rings: 4

     

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