COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK638930
Chemical Name: (4aR,7aS)-4-(1,3-benzodioxol-5-ylmethyl)-1-[4-(propan-2-yl)phenyl]hexahydrothieno[3,4-b]pyrazin-2(1H)-one6,6-dioxide
Smiles: O=C1CN(Cc2ccc3c(c2)OCO3)[C@@H]2[C@H](N1c1ccc(cc1)C(C)C)CS(=O)(=O)C2

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Molecular Weight: 442.54
Empirical Formula: C23H26N2O5S

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 3.468
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 84
Number of rings: 5

     

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