COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK054145
Chemical Name: N-{3-[(4-benzylpiperazin-1-yl)carbonyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl}-2-methylbenzamide
Smiles: O=C(c1c(sc2c1CCCCC2)NC(=O)c1ccccc1C)N1CCN(CC1)Cc1ccccc1

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Molecular Weight: 487.67
Empirical Formula: C29H33N3O2S

Physical State: Dry powder
Available Amount: 396 mg

Lipinsky:
logP: 6.908
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 80
Number of rings: 5

     

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