COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK233789
Chemical Name: 7,7-dimethyl-4,5-dioxo-10-thioxo-4,5,7,10-tetrahydro[1,2]dithiolo[3,4-c]pyrrolo[3,2,1-ij]quinolin-2-ylbenzoate
Smiles: O=C(c1ccccc1)Oc1cc2C(=O)C(=O)N3c2c(c1)c1c(=S)ssc1C3(C)C

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Molecular Weight: 439.54
Empirical Formula: C21H13NO4S3

Physical State: Dry powder
Available Amount: 407 mg

Lipinsky:
logP: 4.73
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 146
Number of rings: 5

     

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