COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK580275
Chemical Name: 16-(4-methoxyphenyl)-3,3-dimethyl-2,3,4,6,7,11,12,16-octahydro-1H,10H-[1,4]dioxepino[2',3':6,7]isoquino[2,1-a]quinolin-1-one
Smiles: COc1ccc(cc1)C1C=C2N(C3=C1C(=O)CC(C3)(C)C)CCc1c2cc2OCCCOc2c1

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Molecular Weight: 457.57
Empirical Formula: C29H31NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.155
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 48
Number of rings: 6

     

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