COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK452395
Chemical Name: methyl2-{[(4-chloro-2-nitrophenyl)carbonyl]amino}-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate
Smiles: COC(=O)c1c(scc1c1ccc(c(c1)OC)OC)NC(=O)c1ccc(cc1[N+](=O)[O-])Cl

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Molecular Weight: 476.89
Empirical Formula: C21H17ClN2O7S

Physical State: Dry powder
Available Amount: 914 mg

Lipinsky:
logP: 5.115
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 147
Number of rings: 3

     

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