COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK437122
Chemical Name: methyl2-[({2-[2-(1,3-benzodioxol-5-yloxy)propanoyl]hydrazinyl}carbonothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)NNC(=O)C(Oc2ccc3c(c2)OCO3)C)sc2c1CCCC2

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Molecular Weight: 477.56
Empirical Formula: C21H23N3O6S2

Physical State: Dry powder
Available Amount: 223 mg

Lipinsky:
logP: 5.805
Rotatable bonds: 6
H-donors: 3
H-acceptors: 6
PSA: 167
Number of rings: 4

     

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