COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK642566
Chemical Name: ethyl4-[(E)-{1-[2-(dimethylamino)ethyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}(hydroxy)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)CCN(C)C)/O)C

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Molecular Weight: 445.54
Empirical Formula: C22H27N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.401
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 131
Number of rings: 3

     

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