COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK422898
Chemical Name: propan-2-yl2-{[(5-bromothiophen-2-yl)carbonyl]amino}-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Smiles: CC(OC(=O)c1c(NC(=O)c2ccc(s2)Br)sc2c1CCCCCCCCCC2)C

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Molecular Weight: 512.53
Empirical Formula: C23H30BrNO3S2

Physical State: Dry powder
Available Amount: 3144 mg

Lipinsky:
logP: 10.636
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 111
Number of rings: 3

     

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