COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK347211
Chemical Name: 2-({[3-nitro-4-(piperidin-1-yl)phenyl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Smiles: O=C(c1ccc(c(c1)[N+](=O)[O-])N1CCCCC1)Nc1sc2c(c1C(=O)N)CCCCC2

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Molecular Weight: 442.54
Empirical Formula: C22H26N4O4S

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: 6.813
Rotatable bonds: 2
H-donors: 3
H-acceptors: 4
PSA: 149
Number of rings: 4

     

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