COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK898850
Chemical Name: methyl2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}-1,3-benzothiazole-6-carboxylate
Smiles: COC(=O)c1ccc2c(c1)sc(n2)NC=C1C(=O)CC(CC1=O)(C)C

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Molecular Weight: 358.42
Empirical Formula: C18H18N2O4S

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 2.815
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 113
Number of rings: 3

     

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