COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL356079
Chemical Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-[1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-3-phenylthiourea
Smiles: Clc1cccc(c1)N1C(=O)CC(C1=O)N(C(=S)Nc1ccccc1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 493.97
Empirical Formula: C25H20ClN3O4S

Physical State: Dry powder
Available Amount: 164 mg

Lipinsky:
logP: 3.571
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 103
Number of rings: 5

     

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