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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

34432609
34432609

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Popular Name: ethyl 4,6-dichloronicotinate ethyl 4,6-dichloronicotinate

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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) 2.54 1.05 -4.28 0 3 0 39 220.055 3 ↓

Analogs

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Popular Name: Ethyl 6-amino-5-bromonicotinate Ethyl 6-amino-5-bromonicotinate

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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) 1.47 3.68 -6.44 2 4 0 65 245.076 3 ↓

Analogs

40456602
40456602
38580618
38580618

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Popular Name: Ethyl 3-cyclopropylpyrazole-4-carboxylate Ethyl 3-cyclopropylpyrazole-4-ca…

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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) 1.04 4.63 -6.39 1 4 0 55 180.207 4 ↓
Ref Reference (pH 7) 1.04 4.66 -8.78 1 4 0 55 180.207 4 ↓

Analogs

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Popular Name: ethyl imidazo[1,2-a]pyrimidine-2-carboxylate ethyl imidazo[1,2-a]pyrimidine-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) 0.82 7.11 -16.67 0 5 0 57 191.19 3 ↓

Analogs

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Popular Name: Ethyl 5-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate Ethyl 5-(trifluoromethyl)imidazo…

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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 7.37 -10.99 0 4 0 44 258.199 4 ↓

Analogs

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Popular Name: Ethyl 5-methylimidazo[1,2-a]pyridine-2-carboxylate Ethyl 5-methylimidazo[1,2-a]pyri…

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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) 1.58 7.03 -11.28 0 4 0 44 204.229 3 ↓

Analogs

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Popular Name: Ethyl 6-chloroimidazo[1,2-b]pyridazine-2-carboxylate Ethyl 6-chloroimidazo[1,2-b]pyri…

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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) 2.04 1.24 -9.23 0 5 0 56 225.635 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 6-aminoimidazo[1,2-a]pyridine-2-carboxylate Ethyl 6-aminoimidazo[1,2-a]pyrid…

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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) 1.18 4.42 -11.57 2 5 0 70 205.217 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 6-chloroimidazo[1,2-a]pyridine-2-carboxylate Ethyl 6-chloroimidazo[1,2-a]pyri…

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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) 2.38 1.88 -8.62 0 4 0 44 224.647 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 6-methylimidazo[1,2-a]pyridine-2-carboxylate Ethyl 6-methylimidazo[1,2-a]pyri…

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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) 2.15 7.21 -10.8 0 4 0 44 204.229 3 ↓

Analogs

39320724
39320724

Draw Identity 99% 90% 80% 70%

Popular Name: ETHYL 6-BROMOIMIDAZO[1,2-A]PYRIDINE-2-CARBOXYLATE ETHYL 6-BROMOIMIDAZO[1,2-A]PYRID…

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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 1.26 -8.46 0 4 0 43 269.098 3 ↓

Analogs

44676348
44676348

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Popular Name: ethyl 7-methylimidazo[1,2-a]pyridine-2-carboxylate ethyl 7-methylimidazo[1,2-a]pyri…

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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) 2.15 7.22 -11.37 0 4 0 44 204.229 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 6-bromo-7-methylimidazo[1,2-a]pyridine-2-carboxylate Ethyl 6-bromo-7-methylimidazo[1,…

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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) 2.89 7.73 -8.32 0 4 0 44 283.125 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 6-bromo-8-fluoroimidazo[1,2-a]pyridine-2-carboxylate Ethyl 6-bromo-8-fluoroimidazo[1,…

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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) 2.60 7.23 -9.48 0 4 0 44 287.088 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: ethyl 8-bromo-6-chloroimidazo[1,2-a]pyridine-2-carboxylate ethyl 8-bromo-6-chloroimidazo[1,…

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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) 3.12 1.09 -8.81 0 4 0 44 303.543 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 8-bromo-6-methylimidazo[1,2-a]pyridine-2-carboxylate Ethyl 8-bromo-6-methylimidazo[1,…

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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) 2.89 7.77 -11.47 0 4 0 44 283.125 3 ↓

Analogs

57701
57701

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Popular Name: Ethyl 1-phenyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate Ethyl 1-phenyl-3-(trifluoromethy…

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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 8.12 -10.46 0 4 0 44 284.237 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate Ethyl 1-methyl-3-(trifluoromethy…

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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) 1.66 4.78 -11.97 0 4 0 44 222.166 4 ↓

Analogs

39292517
39292517

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Popular Name: Ethyl 1-ethyl-6,7,8-trifluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate Ethyl 1-ethyl-6,7,8-trifluoro-4-…

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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) 0.80 5.19 -15.68 0 4 0 48 299.248 4 ↓

Analogs

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Popular Name: ethyl 2-aminothiophene-3-carboxylate ethyl 2-aminothiophene-3-carboxy…

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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) 1.34 3.14 -5.96 2 3 0 52 171.221 3 ↓

Analogs

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Popular Name: Ethyl 2-methylthiophene-3-carboxylate Ethyl 2-methylthiophene-3-carbox…

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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) 1.96 5.67 -5.82 0 2 0 26 170.233 3 ↓

Analogs

36761503
36761503
38251208
38251208

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Popular Name: ETHYL 2-METHYL-3-FUROATE ETHYL 2-METHYL-3-FUROATE

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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) 1.31 4.88 -6.06 0 3 0 39 154.165 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 3-aminopyridazine-4-carboxylate Ethyl 3-aminopyridazine-4-carbox…

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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) -0.05 2.24 -7.09 2 5 0 78 167.168 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 3-chloropyridazine-4-carboxylate Ethyl 3-chloropyridazine-4-carbo…

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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) 1.15 3.59 -9.02 0 4 0 52 186.598 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl pyridazine-4-carboxylate Ethyl pyridazine-4-carboxylate

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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) -0.07 3.25 -6.73 0 4 0 52 152.153 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 4-pyrimidinecarboxylate Ethyl 4-pyrimidinecarboxylate

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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) 0.46 4.1 -6.6 0 4 0 52 152.153 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 3-aminoisonicotinate Ethyl 3-aminoisonicotinate

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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) 1.00 2.4 -5.19 2 4 0 65 166.18 3 ↓

Analogs

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Popular Name: Ethyl 2-methoxyisonicotinate Ethyl 2-methoxyisonicotinate

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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) 1.59 2.8 -6.8 0 4 0 48 181.191 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 2-Aminoisonicotinate Ethyl 2-Aminoisonicotinate

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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) 1.02 3.02 -7.49 2 4 0 65 166.18 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 2-chloroisonicotinate Ethyl 2-chloroisonicotinate

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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) 2.22 1.24 -5.12 0 3 0 39 185.61 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 2-bromoisonicotinate Ethyl 2-bromoisonicotinate

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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 4.82 -5.09 0 3 0 39 230.061 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl imidazo[1,2-a]pyridine-7-carboxylate Ethyl imidazo[1,2-a]pyridine-7-c…

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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) 1.80 6.63 -10.99 0 4 0 44 190.202 3 ↓
Mid Mid (pH 6-8) 1.80 7.11 -33.37 1 4 1 45 191.21 3 ↓

Analogs

32135515
32135515
32135516
32135516

Draw Identity 99% 90% 80% 70%

Popular Name: ethyl thiophene-2-carboxylate ethyl thiophene-2-carboxylate

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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) 2.05 1.41 -5.97 0 2 0 26 156.206 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 2-chloronicotinate Ethyl 2-chloronicotinate

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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) 1.88 4.63 -8.79 0 3 0 39 185.61 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 2-cyanonicotinate Ethyl 2-cyanonicotinate

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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) 1.07 4.37 -13.33 0 4 0 63 176.175 3 ↓

Analogs

21984999
21984999
21985005
21985005

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Popular Name: Ethyl 2-bromonicotinate Ethyl 2-bromonicotinate

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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) 2.01 0.61 -8.37 0 3 0 39 230.061 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 2-(1H-imidazol-1-yl)benzoate Ethyl 2-(1H-imidazol-1-yl)benzoate

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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) 1.64 8.22 -11 0 4 0 44 216.24 4 ↓
Lo Low (pH 4.5-6) 1.64 9.25 -29.73 1 4 1 45 217.248 4 ↓

Analogs

34669592
34669592

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Popular Name: Ethyl 2-sulfamoylbenzoate Ethyl 2-sulfamoylbenzoate

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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) 0.79 1.68 -13.16 2 5 0 86 229.257 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Ethyl 2-hydroxybenzoate Ethyl 2-hydroxybenzoate

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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 4.11 -7.89 1 3 0 47 166.176 3 ↓
Hi High (pH 8-9.5) 2.51 5.12 -49.72 0 3 -1 49 165.168 3 ↓

Analogs

32142177
32142177
32237052
32237052

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Popular Name: Ethyl 2-(methylamino)benzoate Ethyl 2-(methylamino)benzoate

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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) 2.47 0.93 -5.39 1 3 0 38 179.219 4 ↓

Analogs

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Popular Name: 2-Dimethylamino-benzoic acid ethyl ester 2-Dimethylamino-benzoic acid eth…

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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 2.32 -6.91 0 3 0 29 193.246 4 ↓

Analogs

32137832
32137832
32149119
32149119
44200642
44200642

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Popular Name: Ethyl 2-fluorobenzoate Ethyl 2-fluorobenzoate

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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) 2.26 2.95 -9.1 0 2 0 26 168.167 3 ↓

Analogs

39303990
39303990

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Popular Name: Ethyl 2-chlorobenzoate Ethyl 2-chlorobenzoate

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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) 2.78 2.13 -7.06 0 2 0 26 184.622 3 ↓

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Popular Name: Ethyl 2-Cyanobenzoate Ethyl 2-Cyanobenzoate

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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) 1.85 6.23 -12.35 0 3 0 50 175.187 3 ↓

Analogs

44200657
44200657

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Popular Name: ethyl 2-bromobenzoate ethyl 2-bromobenzoate

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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) 2.91 1.57 -6.74 0 2 0 26 229.073 3 ↓

Analogs

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Popular Name: Ethyl benzoate Ethyl benzoate

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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) 2.48 2.3 -5.89 0 2 0 26 150.177 3 ↓

Analogs

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Popular Name: Ethyl 1H-indazole-4-carboxylate Ethyl 1H-indazole-4-carboxylate

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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) 1.79 4.58 -8.64 1 4 0 55 190.202 3 ↓
Ref Reference (pH 7) 1.79 4.68 -8.31 1 4 0 55 190.202 3 ↓

Analogs

39347315
39347315

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Popular Name: Ethyl 5-bromo-1-naphthoate Ethyl 5-bromo-1-naphthoate

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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 8.71 -5.7 0 2 0 26 279.133 3 ↓

Analogs

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Popular Name: Ethyl 1H-indole-4-carboxylate Ethyl 1H-indole-4-carboxylate

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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) 2.32 5.98 -10.22 1 3 0 42 189.214 3 ↓

Analogs

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Popular Name: Ethyl 1H-indazole-7-carboxylate Ethyl 1H-indazole-7-carboxylate

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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) 1.79 4.81 -9.76 1 4 0 55 190.202 3 ↓
Ref Reference (pH 7) 1.79 4.86 -17.24 1 4 0 55 190.202 3 ↓

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catalog.name = angenebb
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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  WHERE c.free = 1 AND c.short_name LIKE 'angenebb' AND ci.sub_id_fk IN (SELECT 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  WHERE c.free = 1 AND c.purchasable IN (1,2,4,5)   )    LIMIT 50

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