COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK280231
Chemical Name: ethyl7-(phenylsulfanyl)-6-[(prop-2-en-1-ylamino)methyl]-2-{2-[(prop-2-en-1-ylamino)methyl]-1H-pyrrol-1-yl}-4,5-dihydro-1-benzothiophene-3-carboxylate
Smiles: C=CCNCC1=C(Sc2ccccc2)c2c(CC1)c(c(s2)n1cccc1CNCC=C)C(=O)OCC

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Molecular Weight: 519.73
Empirical Formula: C29H33N3O2S2

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 7.47
Rotatable bonds: 12
H-donors: 2
H-acceptors: 2
PSA: 108
Number of rings: 4

     

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