COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK066699
Chemical Name: 6-(4-nitrophenyl)-6,12-dihydro-5H-benzo[b]indeno[1,2-e][1,4]thiazepin-5-one7,7-dioxide
Smiles: [O-][N+](=O)c1ccc(cc1)C1C2=C(Nc3c(S1(=O)=O)cccc3)c1c(C2=O)cccc1

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Molecular Weight: 418.43
Empirical Formula: C22H14N2O5S

Physical State: Dry powder
Available Amount: 129 mg

Lipinsky:
logP: 3.749
Rotatable bonds: 0
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 5

     

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