COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK508440
Chemical Name: 3'-ethyl4,5-dimethyl5',5',9'-trimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4,5-tricarboxylate
Smiles: CCOC(=O)C1=CC2(C3=C(S1)C(C)(C)Nc1c3cc(C)cc1)SC(=C(S2)C(=O)OC)C(=O)OC

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Molecular Weight: 519.66
Empirical Formula: C24H25NO6S3

Physical State: Dry powder
Available Amount: 329 mg

Lipinsky:
logP: 9.096
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 166
Number of rings: 4

     

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