COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL310605
Chemical Name: 4-(5-amino-8-methoxy-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: COc1cccc2c1OC(=O)C1=C(N)SC3C(C21)C(=O)N(C3=O)c1ccc(cc1)C(=O)O

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Molecular Weight: 452.44
Empirical Formula: C22H16N2O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.923
Rotatable bonds: 2
H-donors: 3
H-acceptors: 7
PSA: 161
Number of rings: 5

     

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