COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK457409
Chemical Name: methyl2-[({2-[3-(3,4-dihydroxyphenyl)propanoyl]hydrazinyl}carbonothioyl)amino]-5-phenylthiophene-3-carboxylate
Smiles: COC(=O)c1cc(sc1NC(=S)NNC(=O)CCc1ccc(c(c1)O)O)c1ccccc1

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Molecular Weight: 471.56
Empirical Formula: C22H21N3O5S2

Physical State: Dry powder
Available Amount: 190 mg

Lipinsky:
logP: 5.032
Rotatable bonds: 8
H-donors: 5
H-acceptors: 5
PSA: 180
Number of rings: 3

     

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