COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK452398
Chemical Name: methyl2-{[(3,5-dinitrophenyl)carbonyl]amino}-4-(4-methoxyphenyl)thiophene-3-carboxylate
Smiles: COC(=O)c1c(scc1c1ccc(cc1)OC)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 457.42
Empirical Formula: C20H15N3O8S

Physical State: Dry powder
Available Amount: 630 mg

Lipinsky:
logP: 5.063
Rotatable bonds: 2
H-donors: 1
H-acceptors: 8
PSA: 184
Number of rings: 3

     

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