COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL483451
Chemical Name: 1-(4-chlorophenyl)-2-{[(2E)-1-phenyl-1,4,5,6,7,8-hexahydro-1,3-diazocin-2-yl]sulfanyl}ethanone
Smiles: Clc1ccc(cc1)C(=O)CSC1=NCCCCCN1c1ccccc1

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Saltdata: HBr
Molecular Weight: 372.92
Empirical Formula: C20H21ClN2OS

Available Amount: 0 mg

Lipinsky:
logP: 4.85
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 57
Number of rings: 3

     

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