COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK759191
Chemical Name: N-[(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-4-[4-(pyrrolidin-1-ylsulfonyl)phenyl]-1,3-thiazol-2(3H)-ylidene]aniline
Smiles: O=S(=O)(c1ccc(cc1)c1cs/c(=N\c2ccccc2)/n1Cc1ccc2c(c1)OCO2)N1CCCC1

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Saltdata: HBr
Molecular Weight: 519.65
Empirical Formula: C27H25N3O4S2

Physical State: Dry powder
Available Amount: 56 mg

Lipinsky:
logP: 5.839
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 105
Number of rings: 6

     

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