COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK567515
Chemical Name: N,N'-(octane-1,8-diyldi-1,3,4-thiadiazol-2-yl-5-ylidene)bis(2-methylpropanamide)
Smiles: CC(C(=O)/N=c\1/[nH]nc(s1)CCCCCCCCc1n[nH]/c(=N/C(=O)C(C)C)/s1)C

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Molecular Weight: 452.65
Empirical Formula: C20H32N6O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.877
Rotatable bonds: 11
H-donors: 2
H-acceptors: 2
PSA: 158
Number of rings: 2

     

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