COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL561877
Chemical Name: (2R,3'E,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-3'-(1-{[2-(4-oxoquinazolin-3(4H)-yl)ethyl]amino}ethylidene)-2'H,3H,4'H-spiro[1-benzofuran-2,1'-cyclohexane]-2',3,4'-trione
Smiles: COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=O)/C(=C(\NCCn2cnc3c(c2=O)cccc3)/C)/C1=O)Cl

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Molecular Weight: 551.98
Empirical Formula: C28H26ClN3O7

Available Amount: 0 mg

Lipinsky:
logP: 4.152
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 123
Number of rings: 5

     

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