COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552293
Chemical Name: (2S,8'R)-7-chloro-3'-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-4,6-dimethoxy-1',8'-dimethyl-8',9'-dihydro-2'H,3H-spiro[1-benzofuran-2,7'-pyrimido[4,5-b]quinoline]-2',3,4',6'(1'H,3'H)-tetrone
Smiles: COc1cc(ccc1OC)C(=O)Cn1c(=O)c2cc3c(nc2n(c1=O)C)C[C@H]([C@@]1(C3=O)Oc2c(C1=O)c(OC)cc(c2Cl)OC)C

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Molecular Weight: 650.04
Empirical Formula: C32H28ClN3O10

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.794
Rotatable bonds: 7
H-donors: 0
H-acceptors: 10
PSA: 150
Number of rings: 6

     

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