|  | 
Analogs
Draw
Identity
99%
90%
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 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 4.53 | 6.79 | -5.25 | 0 | 3 | 0 | 35 | 268.769 | 5 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.33 | 4.18 | -9.23 | 2 | 4 | 0 | 61 | 249.339 | 5 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
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 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.71 | 5.21 | -9.21 | 1 | 4 | 0 | 47 | 263.366 | 6 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 4.08 | 6.04 | -8.42 | 1 | 4 | 0 | 47 | 277.393 | 7 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
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 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 4.58 | 6.8 | -8.06 | 1 | 4 | 0 | 47 | 291.42 | 8 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
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 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.09 | 3.97 | -9.38 | 3 | 5 | 0 | 73 | 264.354 | 6 | ↓ |  
            | Lo
                Low (pH 4.5-6) | 3.09 | 3.8 | -57.41 | 4 | 5 | 1 | 75 | 265.362 | 6 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
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 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.45 | 4.7 | -10.25 | 0 | 3 | 0 | 35 | 262.668 | 3 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
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70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.91 | 3.77 | -11.23 | 0 | 6 | 0 | 72 | 347.849 | 5 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 1.80 | 1 | -18.69 | 2 | 9 | 0 | 141 | 350.765 | 5 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.26 | 2.1 | -14.53 | 2 | 4 | 0 | 61 | 243.238 | 3 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.63 | 3.13 | -14.47 | 1 | 4 | 0 | 47 | 257.265 | 4 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.01 | 3.96 | -13.62 | 1 | 4 | 0 | 47 | 271.292 | 5 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.51 | 4.72 | -13.3 | 1 | 4 | 0 | 47 | 285.319 | 6 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.02 | 1.89 | -14.56 | 3 | 5 | 0 | 73 | 258.253 | 4 | ↓ |  
            | Lo
                Low (pH 4.5-6) | 2.02 | 1.72 | -63.39 | 4 | 5 | 1 | 75 | 259.261 | 4 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
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70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.74 | 4.04 | -12.68 | 2 | 7 | 0 | 107 | 280.309 | 4 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.11 | 5.07 | -12.38 | 1 | 7 | 0 | 93 | 294.336 | 5 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.49 | 5.9 | -11.49 | 1 | 7 | 0 | 93 | 308.363 | 6 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.50 | 3.83 | -12.83 | 3 | 8 | 0 | 119 | 295.324 | 5 | ↓ |  
            | Lo
                Low (pH 4.5-6) | 2.50 | 3.66 | -66.2 | 4 | 8 | 1 | 121 | 296.332 | 5 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.48 | 4.71 | -4.83 | 0 | 3 | 0 | 35 | 262.668 | 3 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.28 | 2.11 | -8.98 | 2 | 4 | 0 | 61 | 243.238 | 3 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.66 | 3.13 | -8.79 | 1 | 4 | 0 | 47 | 257.265 | 4 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.03 | 3.97 | -7.86 | 1 | 4 | 0 | 47 | 271.292 | 5 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.54 | 4.72 | -7.65 | 1 | 4 | 0 | 47 | 285.319 | 6 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.04 | 1.9 | -9.52 | 3 | 5 | 0 | 73 | 258.253 | 4 | ↓ |  
            | Lo
                Low (pH 4.5-6) | 2.04 | 1.73 | -59.67 | 4 | 5 | 1 | 75 | 259.261 | 4 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.44 | 3.14 | -9.33 | 2 | 4 | 0 | 61 | 320.599 | 3 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.20 | 2.94 | -9.47 | 3 | 5 | 0 | 73 | 335.614 | 4 | ↓ |  
            | Lo
                Low (pH 4.5-6) | 3.20 | 2.76 | -57.76 | 4 | 5 | 1 | 75 | 336.622 | 4 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.73 | 6.85 | -10.76 | 0 | 4 | 0 | 52 | 303.17 | 4 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.98 | 5.13 | -10.67 | 0 | 6 | 0 | 71 | 314.75 | 6 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
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70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.79 | 5.84 | -7.35 | 0 | 6 | 0 | 81 | 306.13 | 4 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.34 | 5.1 | -10.32 | 1 | 7 | 0 | 93 | 314.754 | 6 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
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70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.97 | 4.27 | -11.18 | 1 | 7 | 0 | 93 | 300.727 | 5 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
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70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.59 | 3.23 | -11.36 | 2 | 7 | 0 | 107 | 286.7 | 4 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.85 | 5.85 | -10.02 | 1 | 7 | 0 | 93 | 328.781 | 7 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
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70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.35 | 3.03 | -11.81 | 3 | 8 | 0 | 119 | 301.715 | 5 | ↓ |  
            | Lo
                Low (pH 4.5-6) | 2.35 | 2.86 | -61.42 | 4 | 8 | 1 | 121 | 302.723 | 5 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.15 | 4.29 | -7.07 | 0 | 4 | 0 | 44 | 270.741 | 5 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.21 | 4.31 | -9.76 | 1 | 5 | 0 | 56 | 293.392 | 8 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 1.96 | 1.69 | -10.87 | 2 | 5 | 0 | 70 | 251.311 | 5 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.33 | 2.72 | -10.83 | 1 | 5 | 0 | 56 | 265.338 | 6 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.71 | 3.56 | -10.04 | 1 | 5 | 0 | 56 | 279.365 | 7 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 4.64 | 5.75 | -5.34 | 0 | 3 | 0 | 35 | 340.029 | 3 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.13 | 5.13 | -49.01 | 0 | 5 | -1 | 75 | 269.689 | 4 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.11 | 5.13 | -52.91 | 0 | 5 | -1 | 75 | 269.689 | 4 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.17 | 5.88 | -57.43 | 0 | 5 | -1 | 75 | 269.689 | 4 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.65 | 5.91 | -46.25 | 0 | 5 | -1 | 75 | 283.716 | 5 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 2.72 | 5.03 | -49.55 | 0 | 6 | -1 | 84 | 299.715 | 5 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.79 | 5.66 | -8.77 | 0 | 6 | 0 | 81 | 306.13 | 4 | ↓ |  | 
 
            
        |  | 
Analogs
Draw
Identity
99%
90%
80%
70%
 Physical Representations
    
        
            | Type
                pH range | xlogP | Des A‑Pol
                Apolar desolvation
                (kcal/mol) | Des Pol
                Polar desolvation
                (kcal/mol) | H Don
                H-bond donors | H Acc
                H-bond acceptors | Chg
                Net charge | tPSA 
                (Ų) | MWT
                Molecular weight
                (g/mol) | RB
                Rotatable bonds | DL |  
            | Ref
                Reference (pH 7) | 3.57 | 6.31 | -46.33 | 0 | 5 | -1 | 75 | 283.716 | 4 | ↓ |  |