COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK095031
Chemical Name: (3-chloro-1-benzothiophen-2-yl){(1Z)-1-[(2-methoxyphenyl)imino]-4,4,7-trimethyl-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl}methanone
Smiles: COc1ccccc1/N=c/1\ssc2c1c1ccc(cc1N(C2(C)C)C(=O)c1sc2c(c1Cl)cccc2)C

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Molecular Weight: 563.16
Empirical Formula: C29H23ClN2O2S3

Physical State: Dry powder
Available Amount: 452 mg

Lipinsky:
logP: 10.849
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 120
Number of rings: 6

     

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