UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

538579
538579
541378
541378

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Popular Name: phenyl-[(2R)-tetrahydrofuran-2-yl]BLAH phenyl-[(2R)-tetrahydrofuran-2-y…

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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) 1.44 -0.01 -11.5 0 7 0 70 306.329 2 ↓

Analogs

541378
541378
538576
538576

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Popular Name: phenyl-[(2S)-tetrahydrofuran-2-yl]BLAH phenyl-[(2S)-tetrahydrofuran-2-y…

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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) 1.44 -0.02 -11.46 0 7 0 70 306.329 2 ↓

Analogs

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Popular Name: (4-fluorophenyl)-(p-tolyl)BLAH (4-fluorophenyl)-(p-tolyl)BLAH

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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) 3.72 2.79 -9.8 0 6 0 60 344.353 2 ↓

Analogs

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Popular Name: (4-chlorophenyl)-(3-pyridyl)BLAH (4-chlorophenyl)-(3-pyridyl)BLAH

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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) 2.72 0.79 -10.52 0 7 0 73 347.769 2 ↓

Analogs

2409587
2409587

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Popular Name: (3,4-dimethylphenyl)-(2-furyl)BLAH (3,4-dimethylphenyl)-(2-furyl)BLAH

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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) 3.29 2.73 -12.98 0 7 0 74 330.351 2 ↓

Analogs

534138
534138

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Popular Name: ethyl(phenyl)BLAH ethyl(phenyl)BLAH

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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) 1.65 1.56 -10.09 0 6 0 60 264.292 2 ↓

Analogs

2398165
2398165

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Popular Name: (3-chlorophenyl)-(4-pyridyl)BLAH (3-chlorophenyl)-(4-pyridyl)BLAH

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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) 2.69 0.79 -10.96 0 7 0 73 347.769 2 ↓

Analogs

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Popular Name: (3,4-dimethylphenyl)-ethyl-BLAH (3,4-dimethylphenyl)-ethyl-BLAH

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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) 2.69 2.17 -10.03 0 6 0 60 292.346 2 ↓

Analogs

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Popular Name: tert-butyl-(5-chloro-2-methyl-phenyl)BLAH tert-butyl-(5-chloro-2-methyl-ph…

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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) 4.28 2.35 -9.13 0 6 0 60 340.818 2 ↓

Analogs

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Popular Name: (3,4-dimethylphenyl)-phenyl-BLAH (3,4-dimethylphenyl)-phenyl-BLAH

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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) 4.15 2.35 -11.04 0 6 0 60 340.39 2 ↓

Analogs

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Popular Name: (4-fluorophenyl)-(m-tolyl)BLAH (4-fluorophenyl)-(m-tolyl)BLAH

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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) 3.70 2.79 -9.72 0 6 0 60 344.353 2 ↓

Analogs

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Popular Name: (3-chloro-4-methyl-phenyl)-propyl-BLAH (3-chloro-4-methyl-phenyl)-propy…

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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) 3.42 1.85 -8.99 0 6 0 60 326.791 3 ↓

Analogs

539911
539911

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Popular Name: tert-butyl-(3-chloro-4-methyl-phenyl)BLAH tert-butyl-(3-chloro-4-methyl-ph…

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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) 4.07 2.37 -8.93 0 6 0 60 340.818 2 ↓

Analogs

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Popular Name: (2-methoxyphenyl)-methyl-BLAH (2-methoxyphenyl)-methyl-BLAH

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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) 1.84 1.26 -12.32 0 7 0 70 280.291 2 ↓

Analogs

540836
540836
540849
540849
540989
540989
544044
544044
544418
544418

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Popular Name: tert-butyl-(3-chlorophenyl)BLAH tert-butyl-(3-chlorophenyl)BLAH

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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) 3.67 2.06 -9.39 0 6 0 60 326.791 2 ↓

Analogs

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Popular Name: (3,4-dichlorophenyl)-methyl-BLAH (3,4-dichlorophenyl)-methyl-BLAH

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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) 2.58 1.27 -8.68 0 6 0 60 319.155 1 ↓

Analogs

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Popular Name: methyl(phenethyl)BLAH methyl(phenethyl)BLAH

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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) 1.81 10.1 -9.24 0 6 0 61 278.319 3 ↓

Analogs

2409587
2409587

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Popular Name: 2-furyl(phenyl)BLAH 2-furyl(phenyl)BLAH

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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) 2.25 10.27 -13.08 0 7 0 74 302.297 2 ↓

Analogs

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Popular Name: (3-fluorophenyl)-(m-tolyl)BLAH (3-fluorophenyl)-(m-tolyl)BLAH

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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) 3.89 2.79 -10.74 0 6 0 60 344.353 2 ↓

Analogs

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Popular Name: (3-fluorophenyl)-(p-tolyl)BLAH (3-fluorophenyl)-(p-tolyl)BLAH

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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) 3.70 2.79 -10.51 0 6 0 60 344.353 2 ↓

Analogs

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Popular Name: (4-fluorophenyl)-(3-pyridyl)BLAH (4-fluorophenyl)-(3-pyridyl)BLAH

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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) 2.20 1.68 -10.76 0 7 0 73 331.314 2 ↓

Analogs

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Popular Name: 4-(phenylBLAHyl)resorcinol 4-(phenylBLAHyl)resorcinol

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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) 2.34 6.85 -13.14 2 8 0 101 344.334 2 ↓
Lo Low (pH 4.5-6) 2.14 9.3 -74.17 2 8 0 105 344.334 1 ↓

Analogs

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Popular Name: phenethyl(phenyl)BLAH phenethyl(phenyl)BLAH

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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) 3.08 1.89 -10.35 0 6 0 60 340.39 4 ↓

Analogs

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Popular Name: (3-fluorophenyl)-phenyl-BLAH (3-fluorophenyl)-phenyl-BLAH

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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) 3.25 2.48 -10.82 0 6 0 60 330.326 2 ↓

Analogs

534138
534138
539911
539911

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Popular Name: (3-chlorophenyl)-propyl-BLAH (3-chlorophenyl)-propyl-BLAH

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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) 3.02 11.12 -9.42 0 6 0 61 312.764 3 ↓

Analogs

539911
539911

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Popular Name: tert-butyl-(4-chlorophenyl)BLAH tert-butyl-(4-chlorophenyl)BLAH

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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) 3.48 2.06 -8.21 0 6 0 60 326.791 2 ↓

Analogs

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Popular Name: (3-chloro-4-methyl-phenyl)-ethyl-BLAH (3-chloro-4-methyl-phenyl)-ethyl…

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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) 2.92 1.73 -9.26 0 6 0 60 312.764 2 ↓

Analogs

534138
534138
539911
539911

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Popular Name: tert-butyl(phenyl)BLAH tert-butyl(phenyl)BLAH

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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) 2.81 2.2 -9.82 0 6 0 60 292.346 2 ↓

Analogs

2791007
2791007

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Popular Name: 2-[(4-fluorophenyl)BLAHyl]phenol 2-[(4-fluorophenyl)BLAHyl]phenol

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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) 3.01 0.74 -11.29 1 7 0 81 346.325 2 ↓

Analogs

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Popular Name: (4-chlorophenyl)-(4-pyridyl)BLAH (4-chlorophenyl)-(4-pyridyl)BLAH

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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) 2.50 0.79 -9.83 0 7 0 73 347.769 2 ↓

Analogs

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Popular Name: cyclohexyl-(4-fluorophenyl)BLAH cyclohexyl-(4-fluorophenyl)BLAH

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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) 3.15 2 -8.08 0 6 0 60 336.374 2 ↓

Analogs

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Popular Name: cyclohexyl-(2,4-dimethylphenyl)BLAH cyclohexyl-(2,4-dimethylphenyl)BLAH

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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) 4.02 2.3 -8.88 0 6 0 60 346.438 2 ↓

Analogs

2404137
2404137

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Popular Name: (2,4-dimethylphenyl)-(3-pyridyl)BLAH (2,4-dimethylphenyl)-(3-pyridyl)…

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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) 3.08 1.56 -11.58 0 7 0 73 341.378 2 ↓

Analogs

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Popular Name: (4-fluorophenyl)-phenyl-BLAH (4-fluorophenyl)-phenyl-BLAH

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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) 3.27 2.47 -9.81 0 6 0 60 330.326 2 ↓

Analogs

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Popular Name: (4-fluorophenyl)-(2-thienyl)BLAH (4-fluorophenyl)-(2-thienyl)BLAH

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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) 3.06 1.56 -10.45 0 6 0 60 336.355 2 ↓

Analogs

2409587
2409587

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Popular Name: (4-chlorophenyl)-(2-furyl)BLAH (4-chlorophenyl)-(2-furyl)BLAH

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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) 2.93 1.97 -11.55 0 7 0 74 336.742 2 ↓

Analogs

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Popular Name: (3-chloro-4-methyl-phenyl)-methyl-BLAH (3-chloro-4-methyl-phenyl)-methy…

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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) 2.35 1.71 -9.57 0 6 0 60 298.737 1 ↓

Analogs

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Popular Name: (2-fluorophenyl)-(p-tolyl)BLAH (2-fluorophenyl)-(p-tolyl)BLAH

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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) 3.67 2.78 -12.5 0 6 0 60 344.353 2 ↓

Analogs

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Popular Name: (4-fluorophenyl)-methyl-BLAH (4-fluorophenyl)-methyl-BLAH

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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) 1.25 2.28 -9.15 0 6 0 60 268.255 1 ↓

Analogs

534138
534138

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Popular Name: methyl(phenyl)BLAH methyl(phenyl)BLAH

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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) 1.08 9.21 -10.38 0 6 0 61 250.265 1 ↓

Analogs

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Popular Name: (4-fluorophenyl)-(4-pyridyl)BLAH (4-fluorophenyl)-(4-pyridyl)BLAH

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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) 1.98 1.67 -10.1 0 7 0 73 331.314 2 ↓

Analogs

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Popular Name: (2,4-dimethylphenyl)-phenyl-BLAH (2,4-dimethylphenyl)-phenyl-BLAH

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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) 4.15 13.71 -10.76 0 6 0 61 340.39 2 ↓

Analogs

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Popular Name: (4-chlorophenyl)-methyl-BLAH (4-chlorophenyl)-methyl-BLAH

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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) 2.51 0.86 -8.74 0 6 0 60 284.71 1 ↓

Analogs

2796735
2796735
6810141
6810141
6810169
6810169
6810170
6810170
6810171
6810171

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Popular Name: (2-chlorophenoxy)methyl-phenyl-BLAH (2-chlorophenoxy)methyl-phenyl-BLAH

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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) 3.38 1.25 -13.79 0 7 0 70 376.807 4 ↓

Analogs

2797552
2797552

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Popular Name: phenyl-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]BLAH phenyl-[3-(1,1,2,2-tetrafluoroet…

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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) 4.34 12.98 -12.43 0 7 0 70 428.349 5 ↓

Analogs

2800578
2800578
5180305
5180305
5205815
5205815
6408122
6408122
27795865
27795865

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Popular Name: [2-(difluoromethoxy)phenyl]-phenyl-BLAH [2-(difluoromethoxy)phenyl]-phen…

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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) 3.68 2.98 -13.81 0 7 0 70 378.342 4 ↓

Analogs

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Popular Name: (3-methoxyphenyl)-phenyl-BLAH (3-methoxyphenyl)-phenyl-BLAH

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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) 3.14 1.76 -12.13 0 7 0 70 342.362 3 ↓

Analogs

2802191
2802191

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Popular Name: [5-[(4-methoxyphenoxy)methyl]-2-furyl]-phenyl-BLAH [5-[(4-methoxyphenoxy)methyl]-2-…

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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) 4.20 13 -16.1 0 9 0 93 438.447 6 ↓

Analogs

2800184
2800184
2800471
2800471
2800605
2800605
2800684
2800684
2800725
2800725

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Popular Name: [5-[(4-fluorophenoxy)methyl]-2-furyl]-phenyl-BLAH [5-[(4-fluorophenoxy)methyl]-2-f…

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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) 4.31 13.79 -15.4 0 8 0 83 426.411 5 ↓

Analogs

6810141
6810141
6810169
6810169
6810170
6810170
6810171
6810171
6810179
6810179

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Popular Name: (4-chloro-3,5-dimethyl-phenoxy)methyl-phenyl-BLAH (4-chloro-3,5-dimethyl-phenoxy)m…

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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) 4.18 1.82 -12 0 7 0 70 404.861 4 ↓

Parameters Provided:

ring.id = 221005
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 221005 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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