COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL514223
Chemical Name: (4Z)-4-{4-[(3,4-dimethylphenyl)amino]-8-ethoxy-1,3-dimethyl-6H-cyclohepta[c]furan-6-ylidene}-2-ethoxycyclohexa-2,5-dien-1-one
Smiles: CCOC1=C/C(=C/2\C=C(OCC)c3c(C(=C2)Nc2ccc(c(c2)C)C)c(oc3C)C)/C=CC1=O

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Molecular Weight: 457.57
Empirical Formula: C29H31NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.334
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 60
Number of rings: 4

     

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