COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL457893
Chemical Name: (12aS)-2-{[(E)-thiophen-2-ylmethylidene]amino}-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1CN(/N=C/c2cccs2)C(=O)[C@H]2N1Cc1[nH]c3c(c1C2)cccc3

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Molecular Weight: 364.43
Empirical Formula: C19H16N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.805
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 97
Number of rings: 5

     

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