COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741999
Chemical Name: (4Z)-2,5-bis(4-methoxyphenyl)-4-{1-[(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)amino]ethylidene}-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(cc1)C1=NN(C(=O)/C/1=C(\NCCSCc1nc[nH]c1C)/C)c1ccc(cc1)OC

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Molecular Weight: 491.61
Empirical Formula: C26H29N5O3S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 3.031
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 117
Number of rings: 4

     

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