COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL001909
Chemical Name: ethyl2-amino-5-[(dimethylamino)methyl]-4-(4-nitrophenyl)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N)sc(c1c1ccc(cc1)[N+](=O)[O-])CN(C)C

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Saltdata: HCl
Molecular Weight: 349.41
Empirical Formula: C16H19N3O4S

Physical State: Dry powder
Available Amount: 589 mg

Lipinsky:
logP: 3.439
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 129
Number of rings: 2

     

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