COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK458100
Chemical Name: methyl2-{[(3-carbamoyl-1-methyl-1H-pyrazol-4-yl)carbamothioyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)Nc2cn(nc2C(=O)N)C)sc2c1CCCCC2

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Molecular Weight: 407.52
Empirical Formula: C17H21N5O3S2

Physical State: Dry powder
Available Amount: 229 mg

Lipinsky:
logP: 3.829
Rotatable bonds: 3
H-donors: 4
H-acceptors: 3
PSA: 171
Number of rings: 3

     

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