COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK164435
Chemical Name: ethyl4-{[(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-5-(2-{[4-(ethoxycarbonyl)phenyl]amino}-2-oxoethyl)-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CC1S/C(=N\c2ccc(cc2)C(=O)OCC)/N(C1=O)Cc1ccc2c(c1)OCO2

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Molecular Weight: 603.65
Empirical Formula: C31H29N3O8S

Physical State: Dry powder
Available Amount: 122 mg

Lipinsky:
logP: 6.614
Rotatable bonds: 8
H-donors: 1
H-acceptors: 8
PSA: 158
Number of rings: 5

     

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