COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK477084
Chemical Name: methyl2-{[(4-ethylpiperazin-1-yl)acetyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: CCN1CCN(CC1)CC(=O)Nc1sc2c(c1C(=O)OC)CCCCCC2

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Molecular Weight: 393.55
Empirical Formula: C20H31N3O3S

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 4.862
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 90
Number of rings: 3

     

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