COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL446935
Chemical Name: 2-(1H-benzotriazol-1-yl)-N-[2-{[4-(dimethylamino)phenyl]amino}-1-(3-methoxyphenyl)-2-oxoethyl]-N-(pyridin-3-ylmethyl)acetamide
Smiles: COc1cccc(c1)C(N(C(=O)Cn1nnc2c1cccc2)Cc1cccnc1)C(=O)Nc1ccc(cc1)N(C)C

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Molecular Weight: 549.63
Empirical Formula: C31H31N7O3

Physical State: Dry powder
Available Amount: 22 mg

Lipinsky:
logP: 4.238
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 105
Number of rings: 5

     

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