COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK993781
Chemical Name: 2-chloro-1-[(7E)-3-(4-methoxyphenyl)-7-(naphthalen-2-ylmethylidene)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]ethanone
Smiles: COc1ccc(cc1)C1N(N=C2C1CCC/C/2=C\c1ccc2c(c1)cccc2)C(=O)CCl

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Molecular Weight: 444.96
Empirical Formula: C27H25ClN2O2

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 5.108
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 41
Number of rings: 5

     

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