COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK892074
Chemical Name: 2-methyl-N-({4-[4-nitro-3-(piperidin-1-yl)phenyl]piperazin-1-yl}carbonothioyl)propanamide
Smiles: O=C(C(C)C)NC(=S)N1CCN(CC1)c1ccc(c(c1)N1CCCCC1)[N+](=O)[O-]

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Molecular Weight: 419.55
Empirical Formula: C20H29N5O3S

Physical State: Dry powder
Available Amount: 46 mg

Lipinsky:
logP: 3.63
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 116
Number of rings: 3

     

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