COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK576614
Chemical Name: 4-[(Z)-(4-iminio-7,8-dimethyl-2-oxo-2H-pyrimido[2,1-b][1,3]benzothiazol-3(4H)-ylidene)methyl]-2-methoxyphenolate
Smiles: COc1cc(ccc1[O-])/C=C/1\C(=O)N=c2n(C1=[NH2+])c1cc(C)c(cc1s2)C

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Molecular Weight: 379.44
Empirical Formula: C20H17N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.629
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 115
Number of rings: 4

     

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