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

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Nialamide Nialamide

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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) 0.38 3.48 -12.83 3 6 0 83 298.346 7 ↓

Analogs

3977787
3977787
8674071
8674071
3871476
3871476

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Popular Name: ALOIN ALOIN

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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) -0.08 -7.71 -16.88 7 10 0 177 434.397 4 ↓
Hi High (pH 8-9.5) -0.08 -6.72 -63.06 6 10 -1 180 433.389 4 ↓
Hi High (pH 8-9.5) -0.08 -6.72 -66.89 6 10 -1 180 433.389 4 ↓

Analogs

8674071
8674071
3871476
3871476
3977786
3977786

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Popular Name: ALOIN ALOIN

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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) -0.08 -7.71 -16.35 7 10 0 177 434.397 4 ↓
Hi High (pH 8-9.5) -0.08 -6.71 -64.23 6 10 -1 180 433.389 4 ↓
Hi High (pH 8-9.5) -0.08 -6.71 -64.86 6 10 -1 180 433.389 4 ↓

Analogs

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Popular Name: Chlorpyrifos Chlorpyrifos

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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) 5.16 8.32 -14.54 0 4 0 41 350.591 6 ↓

Analogs

21299910
21299910
607702
607702

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Popular Name: CYPERMETHRIN CYPERMETHRIN

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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) 6.39 14.13 -8.57 0 4 0 59 416.304 7 ↓

Analogs

21299910
21299910
607702
607702

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Popular Name: CYPERMETHRIN CYPERMETHRIN

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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) 6.39 14.2 -9.47 0 4 0 59 416.304 7 ↓

Analogs

21299910
21299910
607702
607702

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Popular Name: CYPERMETHRIN CYPERMETHRIN

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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) 6.39 14.19 -8.81 0 4 0 59 416.304 7 ↓

Analogs

21299910
21299910
607702
607702

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Popular Name: CYPERMETHRIN CYPERMETHRIN

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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) 6.39 14.12 -8.18 0 4 0 59 416.304 7 ↓

Analogs

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Popular Name: Fenthion Fenthion

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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) 3.86 9.46 -14.45 0 3 0 28 278.335 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Picotamide Picotamide

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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 5.75 -16.89 2 7 0 93 376.416 7 ↓

Analogs

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Popular Name: Propoxur Propoxur

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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) 1.67 3.88 -11.25 1 4 0 48 209.245 4 ↓

Analogs

3798074
3798074

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Popular Name: ACADESINE ACADESINE

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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 -8.42 -19.65 7 9 0 157 258.234 3 ↓

Analogs

4877289
4877289
4877291
4877291
4877292
4877292
4877294
4877294
11616871
11616871

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Popular Name: Acadesine Acadesine

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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 -8.5 -13.37 7 9 0 157 258.234 3 ↓

Analogs

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Popular Name: ACETAMINOSALOL ACETAMINOSALOL

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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 5.62 -15.26 2 5 0 76 271.272 4 ↓
Hi High (pH 8-9.5) 3.05 6.63 -58.56 1 5 -1 78 270.264 4 ↓

Analogs

8035017
8035017
11638641
11638641
36294576
36294576
43587537
43587537
4538772
4538772

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Popular Name: ADELMIDROL ADELMIDROL

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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) 0.33 -2.28 -18.29 4 6 0 99 274.361 12 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Allylthiourea Allylthiourea

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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) 0.56 1.3 -11.42 3 2 0 38 116.189 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-Aminothiazole 2-Aminothiazole

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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) 0.48 0.61 -5.02 2 2 0 39 100.146 0 ↓
Lo Low (pH 4.5-6) 0.48 1.12 -27.14 3 2 1 40 101.154 0 ↓

Analogs

43920001
43920001
43920003
43920003
338293
338293

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Popular Name: Artemisinin Artemisinin

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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) 3.32 -0.99 -12.65 0 5 0 54 282.336 0 ↓

Analogs

8214363
8214363
14263142
14263142

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Popular Name: ARTEMOTIL ARTEMOTIL

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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) 3.77 -2.15 -5.89 0 5 0 46 312.406 2 ↓

Analogs

14263142
14263142
8214360
8214360

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Popular Name: ARTEMOTIL ARTEMOTIL

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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) 3.77 -1.25 -5.5 0 5 0 46 312.406 2 ↓

Analogs

15449187
15449187

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Popular Name: ARTENIMOL ARTENIMOL

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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 3.66 -6.09 1 5 0 57 284.352 0 ↓

Analogs

15449189
15449189

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Popular Name: Artenimol Artenimol

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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 3.29 -6.48 1 5 0 57 284.352 0 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Benzyl isothiocyanate Benzyl isothiocyanate

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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 4.91 -2.94 0 1 0 12 149.218 2 ↓
Mid Mid (pH 6-8) 3.01 5.47 -29.74 1 1 1 14 150.226 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Bergapten Bergapten

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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) 2.28 5.76 -10.08 0 4 0 53 216.192 1 ↓

Analogs

2143290
2143290
2143292
2143292
4800575
4800575
4800576
4800576
5820919
5820919

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Popular Name: Bornyl acetate Bornyl acetate

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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 3.3 -4.81 0 2 0 26 196.29 2 ↓

Analogs

4800575
4800575
4800576
4800576

Draw Identity 99% 90% 80% 70%

Popular Name: Bornyl acetate Bornyl acetate

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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 3.24 -4.98 0 2 0 26 196.29 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Broxyquinoline Broxyquinoline

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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 3.28 -5.93 1 2 0 33 302.953 0 ↓
Mid Mid (pH 6-8) 3.48 4.05 -40.83 0 2 -1 36 301.945 0 ↓

Analogs

39899474
39899474
39899475
39899475

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Popular Name: Citiolone Citiolone

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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) -0.02 1.29 -16.17 1 3 0 46 159.21 1 ↓

Analogs

39899474
39899474
39899475
39899475

Draw Identity 99% 90% 80% 70%

Popular Name: Citiolone Citiolone

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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) -0.02 1.29 -16.16 1 3 0 46 159.21 1 ↓

Analogs

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Popular Name: CLOFOCTOL CLOFOCTOL

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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) 8.20 10.96 -4.05 1 1 0 20 365.344 5 ↓

Analogs

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Popular Name: CRESOTAMIDE CRESOTAMIDE

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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 -2.3 -10.47 3 3 0 63 151.165 1 ↓

Analogs

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Popular Name: DECIMEMIDE DECIMEMIDE

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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) 4.86 0.16 -11.19 2 5 0 70 337.46 13 ↓

Analogs

4212915
4212915

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Popular Name: DICHLORISONE ACETATE DICHLORISONE ACETATE

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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) 3.83 1.43 -12.44 1 5 0 80 455.378 4 ↓

Analogs

4212915
4212915

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Popular Name: DICHLORISONE ACETATE DICHLORISONE ACETATE

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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) 3.83 1.52 -12.62 1 5 0 80 455.378 4 ↓

Analogs

3875514
3875514
3875515
3875515

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Popular Name: DICHLORISONE ACETATE DICHLORISONE ACETATE

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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) 3.83 9.39 -14 1 5 0 81 455.378 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: DICHLORISONE ACETATE DICHLORISONE ACETATE

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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) 3.83 9.4 -13.54 1 5 0 81 455.378 4 ↓

Analogs

26516460
26516460
34939306
34939306
34939334
34939334

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Popular Name: Edaravone Edaravone

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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) 1.33 4.95 -14.59 1 3 0 38 174.203 1 ↓
Ref Reference (pH 7) 1.78 5.2 -11.06 0 3 0 33 174.203 1 ↓
Mid Mid (pH 6-8) 1.79 3.03 -7.71 1 3 0 38 174.203 1 ↓

Analogs

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Popular Name: ELLAGIC ACID ELLAGIC 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) 0.94 -1.09 -13.29 4 8 0 141 302.194 0 ↓
Hi High (pH 8-9.5) 0.49 -0.46 -37.99 3 8 -1 144 301.186 0 ↓
Hi High (pH 8-9.5) 0.94 -0.07 -45.06 3 8 -1 144 301.186 0 ↓

Analogs

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Popular Name: Ethaverine hydrochloride Ethaverine 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) 5.02 11.11 -11.96 0 5 0 50 395.499 10 ↓
Lo Low (pH 4.5-6) 5.02 11.29 -41.15 1 5 1 51 396.507 10 ↓

Analogs

608379
608379

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Popular Name: Fipexide Hydrochloride Fipexide 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) 3.20 7.74 -15.82 0 6 0 51 388.851 5 ↓

Analogs

12409058
12409058

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Popular Name: 5-Hydroxy-2-adamantanone 5-Hydroxy-2-adamantanone

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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) 1.14 2.39 -5.27 1 2 0 37 166.22 0 ↓

Analogs

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Popular Name: Irsogladine maleate Irsogladine maleate

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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) 2.31 7.44 -6.92 4 5 0 91 256.096 1 ↓

Analogs

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Popular Name: ISAXONINE ISAXONINE

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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 4.68 -5.6 1 3 0 38 137.186 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Khellin Khellin

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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) 2.29 6.27 -12.84 0 5 0 62 260.245 2 ↓

Analogs

1238584
1238584

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Popular Name: 3-Methyl-1-pentyn-3-ol 3-Methyl-1-pentyn-3-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) 1.15 1.44 -3.1 1 1 0 20 98.145 1 ↓

Analogs

1238583
1238583

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Popular Name: 3-Methyl-1-pentyn-3-ol 3-Methyl-1-pentyn-3-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) 1.15 1.4 -3.15 1 1 0 20 98.145 1 ↓

Analogs

34334111
34334111

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Popular Name: m-Tolyl acetate m-Tolyl acetate

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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) 1.91 6.38 -7.6 0 2 0 26 150.177 2 ↓

Analogs

4087599
4087599
39565202
39565202
39565203
39565203

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Popular Name: METHOPRENE (S) METHOPRENE (S)

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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) 5.36 11.37 -5.54 0 3 0 36 310.478 11 ↓

Analogs

43772721
43772721
43772723
43772723
43772724
43772724
43772726
43772726
43772732
43772732

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Popular Name: MEVASTATIN MEVASTATIN

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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) 4.11 10.9 -13.8 1 5 0 73 390.52 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: MEVASTATIN MEVASTATIN

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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) 4.11 10.68 -12.93 1 5 0 73 390.52 7 ↓

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page.num = 1
catalog.name = msintdrugs
filter.purchasability = purchasable

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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 'msintdrugs' 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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