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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

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Popular Name: 9-Amino minocycline hydrochloride 9-Amino minocycline hydrochloride

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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 1.09 -50.91 8 11 0 195 472.498 3 ↓
Hi High (pH 8-9.5) -1.02 0.91 -233.58 5 11 -3 199 469.474 3 ↓
Hi High (pH 8-9.5) -1.02 -0.07 -134.39 6 11 -2 196 470.482 3 ↓

Analogs

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Popular Name: 9-Amino minocycline hydrochloride 9-Amino minocycline hydrochloride

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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 1.22 -44.1 8 11 0 195 472.498 3 ↓
Hi High (pH 8-9.5) -1.02 3.03 -232.42 5 11 -3 199 469.474 3 ↓
Hi High (pH 8-9.5) -1.02 2.04 -134.98 6 11 -2 196 470.482 3 ↓

Analogs

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Popular Name: 9-Amino minocycline hydrochloride 9-Amino minocycline hydrochloride

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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 0.98 -51.74 8 11 0 195 472.498 3 ↓
Hi High (pH 8-9.5) -1.02 1.4 -234.74 5 11 -3 199 469.474 3 ↓
Hi High (pH 8-9.5) -1.02 0.43 -134.68 6 11 -2 196 470.482 3 ↓

Analogs

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Popular Name: 5-Bromo-2-nitrophenol 5-Bromo-2-nitrophenol

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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

Analogs

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Popular Name: (S)-2-(Methoxymethyl)pyrrolidin-1-amine (S)-2-(Methoxymethyl)pyrrolidin-…

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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

Analogs

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Popular Name: (Tetrahydro-2H-pyran-4-yl)hydrazine (Tetrahydro-2H-pyran-4-yl)hydrazine

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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
Hi High (pH 8-9.5) 1.85 5.76 -19.81 1 4 0 60 212.245 5 ↓

Analogs

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Popular Name: 1,2,3,4-Tetrahydro-2,7-naphthyridine 1,2,3,4-Tetrahydro-2,7-naphthyri…

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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
Hi High (pH 8-9.5) 2.96 7.04 -31.07 3 3 1 38 292.406 2 ↓

Analogs

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Popular Name: N-(3-(Dimethylamino)propyl)propionimidamide hydrochloride N-(3-(Dimethylamino)propyl)propi…

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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) 0.83 3.87 -85.43 4 3 2 44 159.277 5 ↓
Ref Reference (pH 7) 0.96 3.81 -84.7 4 3 2 42 159.277 6 ↓
Hi High (pH 8-9.5) 0.83 1.1 -29.12 3 3 1 43 158.269 5 ↓

Analogs

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Popular Name: 5-(4-Dimethylamino-phenyl)-2H-pyrazol-3-ylamine 5-(4-Dimethylamino-phenyl)-2H-py…

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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) 1.06 0.98 -41.93 5 4 1 55 207.301 2 ↓
Mid Mid (pH 6-8) 1.06 1.74 -57.59 6 4 0 56 208.309 2 ↓

Analogs

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Popular Name: 5-(4-Dimethylamino-phenyl)-2H-pyrazol-3-ylamine 5-(4-Dimethylamino-phenyl)-2H-py…

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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) 1.06 1.12 -44.77 5 4 1 55 207.301 2 ↓
Mid Mid (pH 6-8) 1.06 1.86 -64.12 6 4 0 56 208.309 2 ↓

Analogs

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Popular Name: 5-(4-Dimethylamino-phenyl)-2H-pyrazol-3-ylamine 5-(4-Dimethylamino-phenyl)-2H-py…

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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) 1.06 1.08 -44.8 5 4 1 55 207.301 2 ↓
Mid Mid (pH 6-8) 1.06 1.81 -59.12 6 4 0 56 208.309 2 ↓

Analogs

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Popular Name: 5-(4-Dimethylamino-phenyl)-2H-pyrazol-3-ylamine 5-(4-Dimethylamino-phenyl)-2H-py…

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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) 1.06 1.02 -44.44 5 4 1 55 207.301 2 ↓
Mid Mid (pH 6-8) 1.06 1.77 -57.99 6 4 0 56 208.309 2 ↓

Analogs

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Popular Name: Fluoren-2-yl-hydrazine Fluoren-2-yl-hydrazine

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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) 3.05 6.3 -5.88 3 2 0 38 196.253 1 ↓
Lo Low (pH 4.5-6) 3.05 6.09 -49.79 4 2 1 40 197.261 1 ↓

Analogs

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Popular Name: 3-Methylaminopiperidine dihydrochloride 3-Methylaminopiperidine dihydroc…

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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

Analogs

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Popular Name: 3-Methylaminopiperidine dihydrochloride 3-Methylaminopiperidine dihydroc…

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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

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Popular Name: 4-Fluoro-1H-indazol-6-ol 4-Fluoro-1H-indazol-6-ol

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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) 1.22 0.35 -5.83 2 3 0 49 152.128 0 ↓
Hi High (pH 8-9.5) 1.22 1.1 -37.83 1 3 -1 52 151.12 0 ↓
Hi High (pH 8-9.5) 1.22 1.19 -48.98 1 3 -1 52 151.12 0 ↓

Analogs

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Popular Name: decamethylzirconocenedichloride decamethylzirconocenedichloride

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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

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Popular Name: Ethylferrocene Ethylferrocene

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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

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Popular Name: 4-Methylpyrimidine-2-thiol hydrochloride 4-Methylpyrimidine-2-thiol hydro…

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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

Analogs

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Popular Name: (R)-METHYL 2-AMINO-2-CYCLOPENTYLACETATE HYDROCHLORIDE (R)-METHYL 2-AMINO-2-CYCLOPENTYL…

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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 2.88 -43.74 3 3 1 54 158.221 3 ↓
Mid Mid (pH 6-8) 0.82 2.66 -3.39 2 3 0 52 157.213 3 ↓

Analogs

15977263
15977263

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Popular Name: 2-Acetylcyclohexanone 2-Acetylcyclohexanone

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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) 1.39 3.44 -39.55 0 2 -1 40 139.174 0 ↓
Ref Reference (pH 7) 1.39 5 -49.19 0 2 -1 40 139.174 0 ↓
Mid Mid (pH 6-8) 0.81 3.41 -7.64 0 2 0 34 140.182 1 ↓

Analogs

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Popular Name: 3-Bromo-1H-pyrazol-5-amine 3-Bromo-1H-pyrazol-5-amine

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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) 0.86 0.29 -5.6 3 3 0 55 161.99 0 ↓
Ref Reference (pH 7) 0.41 0.83 -32.98 3 3 1 52 162.998 0 ↓
Mid Mid (pH 6-8) 0.86 0.32 -4 3 3 0 55 161.99 0 ↓

Analogs

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Popular Name: Doxycycline Doxycycline

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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

Analogs

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Popular Name: 3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole 3,3-Dimethyl-1-(trifluoromethyl)…

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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

Analogs

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Popular Name: (1R,3R)-METHYL-1,2,3,4-TETRAHYDRO-2-CHLOROACETYL-1 (1R,3R)-METHYL-1,2,3,4-TETRAHYDR…

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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) 3.62 8.4 -11.97 1 7 0 81 426.856 4 ↓

Analogs

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Popular Name: 5-Hydroxy-2-nitropyridine 5-Hydroxy-2-nitropyridine

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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) 0.95 2.3 -30.64 0 5 -1 82 139.09 1 ↓
Mid Mid (pH 6-8) 0.95 1.57 -10.71 1 5 0 79 140.098 1 ↓
Lo Low (pH 4.5-6) 0.95 1.8 -37.83 2 5 1 80 141.106 1 ↓

Analogs

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Popular Name: (s)-2-aminooct-7-enoicacid (s)-2-aminooct-7-enoicacid

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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) -0.60 3.93 -38.38 3 3 0 68 157.213 6 ↓
Hi High (pH 8-9.5) -0.60 3.58 -44.29 2 3 -1 66 156.205 6 ↓

Analogs

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Popular Name: Adenosine triphosphate Adenosine triphosphate

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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

Analogs

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Popular Name: Adenosine triphosphate Adenosine triphosphate

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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

Analogs

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Popular Name: Adenosine triphosphate Adenosine triphosphate

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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

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Popular Name: (+)-Sparteine (+)-Sparteine

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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

Analogs

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Popular Name: 3-Bromo-2-chloro-5-hydroxypyridine 3-Bromo-2-chloro-5-hydroxypyridine

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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

Analogs

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Popular Name: 9-Amino Minocycline HCl 9-Amino Minocycline HCl

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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) -1.61 0.81 -61.12 6 11 -1 190 471.49 3 ↓
Hi High (pH 8-9.5) -2.34 1.43 -128.68 5 11 -2 193 470.482 2 ↓
Hi High (pH 8-9.5) -2.34 0.44 -62.12 6 11 -1 190 471.49 2 ↓

Analogs

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Popular Name: 9-Amino Minocycline HCl 9-Amino Minocycline HCl

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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) -1.61 0.52 -60.95 6 11 -1 190 471.49 3 ↓
Hi High (pH 8-9.5) -2.34 0.24 -67.06 6 11 -1 190 471.49 2 ↓
Hi High (pH 8-9.5) -2.34 1.24 -134.53 5 11 -2 193 470.482 2 ↓

Analogs

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Popular Name: 9-Amino Minocycline HCl 9-Amino Minocycline HCl

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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) -1.61 2.24 -60.41 6 11 -1 190 471.49 3 ↓
Hi High (pH 8-9.5) -2.34 3.4 -130.68 5 11 -2 193 470.482 2 ↓
Hi High (pH 8-9.5) -2.34 2.41 -65.46 6 11 -1 190 471.49 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 9-Amino Minocycline HCl 9-Amino Minocycline HCl

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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) -1.61 0.83 -53.04 6 11 -1 190 471.49 3 ↓
Hi High (pH 8-9.5) -2.34 1.4 -138.99 5 11 -2 193 470.482 2 ↓
Hi High (pH 8-9.5) -2.34 0.4 -73.37 6 11 -1 190 471.49 2 ↓

Analogs

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Popular Name: (Dichloroiodo)-benzene (Dichloroiodo)-benzene

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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

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Popular Name: 4-Fluoropyridine-3-carboxylic acid 4-Fluoropyridine-3-carboxylic acid

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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) 0.37 2.39 -49.07 0 3 -1 53 140.093 1 ↓
Lo Low (pH 4.5-6) 0.37 2.82 -57.88 1 3 0 54 141.101 1 ↓

Analogs

12404813
12404813
39268945
39268945

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Popular Name: 5-Fluoro-1H-indazole-3-carboxylic acid 5-Fluoro-1H-indazole-3-carboxyli…

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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) 0.60 2.83 -44.18 1 4 -1 69 179.13 1 ↓
Hi High (pH 8-9.5) 1.52 5.06 -94.22 7 8 2 126 425.924 4 ↓

Analogs

2384757
2384757
2389466
2389466

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Popular Name: Fmoc-D-Tyr(tBu)-OH Fmoc-D-Tyr(tBu)-OH

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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) 5.92 0.83 -56.21 1 6 -1 87 458.534 9 ↓

Analogs

2389466
2389466
1576236
1576236

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Popular Name: Fmoc-Tyr(tBu)-OH Fmoc-Tyr(tBu)-OH

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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) 5.92 0.84 -55.16 1 6 -1 87 458.534 9 ↓

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Popular Name: gamma-Aminobutyric acid gamma-Aminobutyric acid

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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) -1.10 0.98 -62.79 3 3 0 68 103.121 3 ↓

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Popular Name: L-PHENYLALANINOL L-PHENYLALANINOL

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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) 0.35 0.74 -38.56 4 2 1 48 152.217 3 ↓
Hi High (pH 8-9.5) 0.35 0.44 -4.06 3 2 0 46 151.209 3 ↓

Analogs

39268948
39268948
6658368
6658368

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Popular Name: 5-chloro-1H-indazole-3-carboxylic acid 5-chloro-1H-indazole-3-carboxyli…

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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) 2.09 3.29 -43.2 1 4 -1 69 195.585 1 ↓

Analogs

39959783
39959783

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Popular Name: Fmoc-N-Me-D-Leu-OH Fmoc-N-Me-D-Leu-OH

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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) 2.97 2.91 -51.65 0 5 -1 69 366.437 7 ↓

Analogs

39959783
39959783

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Popular Name: Fmoc-N-Me-Leu-OH Fmoc-N-Me-Leu-OH

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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) 2.97 2.88 -50.4 0 5 -1 69 366.437 7 ↓

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Popular Name: N-Benzylglycine hydrochloride N-Benzylglycine hydrochloride

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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) -0.17 4.48 -39.43 2 3 0 57 165.192 4 ↓

Analogs

2384760
2384760

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Popular Name: Fmoc-D-Asn-OH Fmoc-D-Asn-OH

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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) 3.10 -3.05 -58.14 3 7 -1 121 353.354 7 ↓

Analogs

1576230
1576230

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Popular Name: Fmoc-Asn-OH Fmoc-Asn-OH

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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) 3.10 -3.05 -58.12 3 7 -1 121 353.354 7 ↓

Analogs

4534300
4534300

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Popular Name: Boc-L-Aspartic Acid 4-Methyl Ester Boc-L-Aspartic Acid 4-Methyl Ester

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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) 0.53 3.24 -51.12 1 7 -1 105 246.239 7 ↓

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page.num = 1
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