COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK373009
Chemical Name: 3-(4-{[(1E)-1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl]amino}-2-thioxo-1,3-diazaspiro[4.4]non-3-en-1-yl)benzoicacid
Smiles: Clc1ccc(c(c1)Cl)/C=C/C(C(C)(C)C)NC1=NC(=S)N(C21CCCC2)c1cccc(c1)C(=O)O

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Molecular Weight: 530.52
Empirical Formula: C27H29Cl2N3O2S

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 6.959
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 97
Number of rings: 4

     

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