COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL252303
Chemical Name: 2-({4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}methyl)-4-(1H-indol-6-ylamino)-4-oxobutanoicacid
Smiles: O=C(CC(C(=O)O)CN1CCN(CC1)CC(=O)N(C)C)Nc1ccc2c(c1)[nH]cc2

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Saltdata: (CH3)2NCO
Molecular Weight: 415.49
Empirical Formula: C21H29N5O4

Physical State: Dry powder
Available Amount: 323 mg

Lipinsky:
logP: 0.16
Rotatable bonds: 6
H-donors: 3
H-acceptors: 4
PSA: 108
Number of rings: 3

     

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