COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK808241
Chemical Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-4-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)butanamide
Smiles: O=C(Nc1ccc(cc1)c1nc2c(s1)cccc2)CCCn1c(=O)c2cccc3c2c(c1=O)ccc3

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Molecular Weight: 491.57
Empirical Formula: C29H21N3O3S

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 5.05
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 6

     

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