COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK368110
Chemical Name: 3-[({4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl}sulfonyl)amino]-N,N,N-trimethylpropan-1-aminium
Smiles: Clc1ccc(cc1)C1=NN(CC1)c1ccc(cc1)S(=O)(=O)NCCC[N+](C)(C)C

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Saltdata: CH3OSO3-
Molecular Weight: 436
Empirical Formula: C21H28ClN4O2S

Physical State: Dry powder
Available Amount: 253 mg

Lipinsky:
logP: -2.156
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 70
Number of rings: 3

     

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