COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK478227
Chemical Name: ethyl2-{[(4-ethylpiperazin-1-yl)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CN2CCN(CC2)CC)sc2c1CCCCC2

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Molecular Weight: 393.55
Empirical Formula: C20H31N3O3S

Physical State: Liquid
Available Amount: 164 mg

Lipinsky:
logP: 4.829
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 90
Number of rings: 3

     

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