COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455800
Chemical Name: 1-(4-nitrophenyl)-3-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)butyl]thiourea
Smiles: CCCC(C12CC3CC(C2)CC(C1)C3)NC(=S)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 387.55
Empirical Formula: C21H29N3O2S

Physical State: Dry powder
Available Amount: 295 mg

Lipinsky:
logP: 6.171
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 101
Number of rings: 5

     

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