COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552278
Chemical Name: [(2S,8'R)-7-chloro-4,6-dimethoxy-1',8'-dimethyl-2',3,4',6'-tetraoxo-1',6',8',9'-tetrahydro-2'H,3H-spiro[1-benzofuran-2,7'-pyrimido[4,5-b]quinolin]-3'(4'H)-yl]acetonitrile
Smiles: N#CCn1c(=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: 510.89
Empirical Formula: C24H19ClN4O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.635
Rotatable bonds: 3
H-donors: 0
H-acceptors: 7
PSA: 139
Number of rings: 5

     

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