COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL318896
Chemical Name: 4-(5-amino-1,3,6-trioxo-3,3a,11b,11c-tetrahydro-6H-chromeno[4',3':4,5]thiopyrano[2,3-c]pyrrol-2(1H)-yl)benzoicacid
Smiles: O=C1N(c2ccc(cc2)C(=O)O)C(=O)C2C1SC(=C1C2c2ccccc2OC1=O)N

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Saltdata: HCl
Molecular Weight: 422.42
Empirical Formula: C21H14N2O6S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 3.358
Rotatable bonds: 1
H-donors: 3
H-acceptors: 6
PSA: 152
Number of rings: 5

     

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