Warning: session_write_close() [function.session-write-close]: open(/tmp/session/sess_1lajejtc9tpog6gh2g5i2hoem5, O_RDWR) failed: No such file or directory (2) in /domains/zinc12/htdocs/lib/zinc/user/ZincAuthentication.php on line 109

Warning: session_write_close() [function.session-write-close]: Failed to write session data (files). Please verify that the current setting of session.save_path is correct (/tmp/session) in /domains/zinc12/htdocs/lib/zinc/user/ZincAuthentication.php on line 109
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: N'-(4-chlorophenyl)-N-[(1S)-1-(4-pyridyl)ethyl]oxamide N'-(4-chlorophenyl)-N-[(1S)-1-(4…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.57 4.47 -7.45 2 5 0 71 303.749 4 ↓
Lo Low (pH 4.5-6) 1.57 4.93 -39.49 3 5 1 72 304.757 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(4-chlorophenyl)-N-[(1R)-1-(4-pyridyl)ethyl]oxamide N'-(4-chlorophenyl)-N-[(1R)-1-(4…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.57 4.46 -7.45 2 5 0 71 303.749 4 ↓
Lo Low (pH 4.5-6) 1.57 4.92 -39.53 3 5 1 72 304.757 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(4-methoxyphenyl)-N-[(1S)-1-(4-pyridyl)ethyl]oxamide N'-(4-methoxyphenyl)-N-[(1S)-1-(…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 3.24 -9.04 2 6 0 80 299.33 5 ↓
Lo Low (pH 4.5-6) 0.95 3.7 -40.51 3 6 1 82 300.338 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(4-methoxyphenyl)-N-[(1R)-1-(4-pyridyl)ethyl]oxamide N'-(4-methoxyphenyl)-N-[(1R)-1-(…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 3.23 -9.09 2 6 0 80 299.33 5 ↓
Lo Low (pH 4.5-6) 0.95 3.69 -40.5 3 6 1 82 300.338 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-chloro-4-methoxy-phenyl)-N-[[2-(dimethylamino)-4-pyridyl]methyl]oxamide N'-(2-chloro-4-methoxy-phenyl)-N…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 4.97 -34.14 3 7 1 85 363.825 6 ↓
Mid Mid (pH 6-8) 1.44 4.64 -8.47 2 7 0 84 362.817 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[3-chloro-4-(propylcarbamoyl)phenyl]-N'-(4-pyridylmethyl)oxamide N-[3-chloro-4-(propylcarbamoyl)p…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.01 3.5 -12.72 3 7 0 100 374.828 7 ↓
Hi High (pH 8-9.5) 1.20 2.7 -48.64 2 7 -1 107 373.82 7 ↓
Lo Low (pH 4.5-6) 1.01 3.95 -46.53 4 7 1 101 375.836 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-cyano-2-isopropoxy-phenyl)-N'-(4-pyridylmethyl)oxamide N-(5-cyano-2-isopropoxy-phenyl)-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.81 4.54 -11.22 2 7 0 104 338.367 6 ↓
Lo Low (pH 4.5-6) 0.81 5.04 -41.65 3 7 1 105 339.375 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-butoxyphenyl)-N'-[[2-(dimethylamino)-4-pyridyl]methyl]oxamide N-(3-butoxyphenyl)-N'-[[2-(dimet…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 6.85 -35.22 3 7 1 85 371.461 9 ↓
Mid Mid (pH 6-8) 2.25 6.56 -10.81 2 7 0 84 370.453 9 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-(dimethylamino)-3-methyl-phenyl]-N'-(4-pyridylmethyl)oxamide N-[4-(dimethylamino)-3-methyl-ph…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.81 4.98 -8.17 2 6 0 74 312.373 5 ↓
Lo Low (pH 4.5-6) 0.81 5.09 -39.29 3 6 1 76 313.381 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[3-(methoxymethyl)phenyl]-N'-(4-pyridylmethyl)oxamide N-[3-(methoxymethyl)phenyl]-N'-(…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.26 2.84 -9.21 2 6 0 80 299.33 6 ↓
Lo Low (pH 4.5-6) 0.26 3.3 -40.49 3 6 1 82 300.338 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(dimethylamino)-5-(trifluoromethyl)phenyl]-N'-(4-pyridylmethyl)oxamide N-[2-(dimethylamino)-5-(trifluor…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.26 5.33 -8.22 2 6 0 74 366.343 6 ↓
Lo Low (pH 4.5-6) 1.26 5.71 -39.3 3 6 1 76 367.351 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[4-(cyanomethyl)phenyl]-N'-(4-pyridylmethyl)oxamide N-[4-(cyanomethyl)phenyl]-N'-(4-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.30 4.29 -13.9 2 6 0 95 294.314 5 ↓
Lo Low (pH 4.5-6) 0.30 4.74 -45.4 3 6 1 96 295.322 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[3-(isopropylcarbamoyl)-4-methyl-phenyl]-N'-[(1S)-1-(4-pyridyl)ethyl]oxamide N-[3-(isopropylcarbamoyl)-4-meth…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.13 4.56 -11.5 3 7 0 100 368.437 6 ↓
Lo Low (pH 4.5-6) 1.13 5.02 -45.07 4 7 1 101 369.445 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[3-(isopropylcarbamoyl)-4-methyl-phenyl]-N'-[(1R)-1-(4-pyridyl)ethyl]oxamide N-[3-(isopropylcarbamoyl)-4-meth…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.13 4.55 -11.67 3 7 0 100 368.437 6 ↓
Lo Low (pH 4.5-6) 1.13 5.01 -44.73 4 7 1 101 369.445 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[3-[isopropyl(methyl)amino]phenyl]-N'-(4-pyridylmethyl)oxamide N-[3-[isopropyl(methyl)amino]phe…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 4.94 -8.28 2 6 0 74 326.4 6 ↓
Lo Low (pH 4.5-6) 1.08 5.4 -39.39 3 6 1 76 327.408 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-[3-[isopropyl(methyl)amino]phenyl]-N-[(1S)-1-(4-pyridyl)ethyl]oxamide N'-[3-[isopropyl(methyl)amino]ph…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 5.79 -8.17 2 6 0 74 340.427 6 ↓
Lo Low (pH 4.5-6) 1.64 6.25 -39.39 3 6 1 76 341.435 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-[3-[isopropyl(methyl)amino]phenyl]-N-[(1R)-1-(4-pyridyl)ethyl]oxamide N'-[3-[isopropyl(methyl)amino]ph…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 5.78 -8.15 2 6 0 74 340.427 6 ↓
Lo Low (pH 4.5-6) 1.64 6.24 -39.39 3 6 1 76 341.435 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[3-[isopropyl(methyl)amino]phenyl]-N'-[(2-methoxy-4-pyridyl)methyl]oxamide N-[3-[isopropyl(methyl)amino]phe…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.48 3.42 -9.01 2 7 0 84 356.426 7 ↓
Lo Low (pH 4.5-6) 1.48 3.84 -78.42 3 7 0 85 357.434 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-tert-butylsulfanylphenyl)-N'-(4-pyridylmethyl)oxamide N-(4-tert-butylsulfanylphenyl)-N…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.95 5.81 -8.18 2 5 0 71 343.452 6 ↓
Lo Low (pH 4.5-6) 1.95 6.27 -40.2 3 5 1 72 344.46 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[(1S)-2-cyano-1-methyl-ethyl]sulfanylphenyl]-N'-(4-pyridylmethyl)oxamide N-[2-[(1S)-2-cyano-1-methyl-ethy…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.54 6.09 -15.26 2 6 0 95 354.435 7 ↓
Hi High (pH 8-9.5) 0.72 5.29 -54.72 1 6 -1 101 353.427 7 ↓
Lo Low (pH 4.5-6) 0.54 6.55 -46.04 3 6 1 96 355.443 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[(1R)-2-cyano-1-methyl-ethyl]sulfanylphenyl]-N'-(4-pyridylmethyl)oxamide N-[2-[(1R)-2-cyano-1-methyl-ethy…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.54 6.08 -15.66 2 6 0 95 354.435 7 ↓
Hi High (pH 8-9.5) 0.72 5.31 -57.05 1 6 -1 101 353.427 7 ↓
Lo Low (pH 4.5-6) 0.54 6.54 -45.5 3 6 1 96 355.443 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(diethylcarbamoyl)phenyl]-N'-[(1S)-1-(4-pyridyl)ethyl]oxamide N-[2-(diethylcarbamoyl)phenyl]-N…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 6.02 -13.41 2 7 0 91 368.437 7 ↓
Hi High (pH 8-9.5) 0.75 5.25 -53.43 1 7 -1 98 367.429 7 ↓
Lo Low (pH 4.5-6) 0.56 6.48 -44.15 3 7 1 93 369.445 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(diethylcarbamoyl)phenyl]-N'-[(1R)-1-(4-pyridyl)ethyl]oxamide N-[2-(diethylcarbamoyl)phenyl]-N…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 6.01 -13.64 2 7 0 91 368.437 7 ↓
Hi High (pH 8-9.5) 0.75 5.23 -53.39 1 7 -1 98 367.429 7 ↓
Lo Low (pH 4.5-6) 0.56 6.47 -43.4 3 7 1 93 369.445 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-[4-(diallylcarbamoyl)phenyl]-N-[(1S)-1-(4-pyridyl)ethyl]oxamide N'-[4-(diallylcarbamoyl)phenyl]-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 6.78 -11.66 2 7 0 91 392.459 9 ↓
Hi High (pH 8-9.5) 1.33 6 -48.93 1 7 -1 98 391.451 9 ↓
Lo Low (pH 4.5-6) 1.15 7.24 -44.9 3 7 1 93 393.467 9 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-[4-(diallylcarbamoyl)phenyl]-N-[(1R)-1-(4-pyridyl)ethyl]oxamide N'-[4-(diallylcarbamoyl)phenyl]-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 6.77 -11.65 2 7 0 91 392.459 9 ↓
Hi High (pH 8-9.5) 1.33 5.99 -49.23 1 7 -1 98 391.451 9 ↓
Lo Low (pH 4.5-6) 1.15 7.23 -44.96 3 7 1 93 393.467 9 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3-fluorophenyl)-N-methyl-N-[(1S)-1-(4-pyridyl)ethyl]oxamide N'-(3-fluorophenyl)-N-methyl-N-[…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.27 6.29 -9.35 1 5 0 62 301.321 4 ↓
Lo Low (pH 4.5-6) 1.27 6.74 -40.11 2 5 1 64 302.329 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3-fluorophenyl)-N-methyl-N-[(1R)-1-(4-pyridyl)ethyl]oxamide N'-(3-fluorophenyl)-N-methyl-N-[…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.27 5.54 -7.78 1 5 0 62 301.321 4 ↓
Lo Low (pH 4.5-6) 1.27 6 -38.56 2 5 1 64 302.329 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3-ethynylphenyl)-N-[(2-methoxy-4-pyridyl)methyl]oxamide N'-(3-ethynylphenyl)-N-[(2-metho…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.47 2.78 -11.5 2 6 0 80 309.325 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,5-dimethylphenyl)-N'-[(2-methoxy-4-pyridyl)methyl]oxamide N-(2,5-dimethylphenyl)-N'-[(2-me…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.56 3.1 -8.98 2 6 0 80 313.357 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2-methoxy-4-pyridyl)methyl]-N'-phenyl-oxamide N-[(2-methoxy-4-pyridyl)methyl]-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.73 1.59 -8.91 2 6 0 80 285.303 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-bromophenyl)-N-[(2-methoxy-4-pyridyl)methyl]oxamide N'-(2-bromophenyl)-N-[(2-methoxy…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.49 2.35 -8.41 2 6 0 80 364.199 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-[(2-methoxy-4-pyridyl)methyl]-N-(m-tolyl)oxamide N'-[(2-methoxy-4-pyridyl)methyl]…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.16 2.25 -8.88 2 6 0 80 299.33 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,3-dimethylphenyl)-N'-[(2-methoxy-4-pyridyl)methyl]oxamide N-(2,3-dimethylphenyl)-N'-[(2-me…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.53 2.99 -8.97 2 6 0 80 313.357 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-chlorophenyl)-N-[(2-methoxy-4-pyridyl)methyl]oxamide N'-(2-chlorophenyl)-N-[(2-methox…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.36 2.21 -8.43 2 6 0 80 319.748 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3,4-dichlorophenyl)-N-[(2-methoxy-4-pyridyl)methyl]oxamide N'-(3,4-dichlorophenyl)-N-[(2-me…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 2.56 -9.69 2 6 0 80 354.193 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3-chlorophenyl)-N-[(2-methoxy-4-pyridyl)methyl]oxamide N'-(3-chlorophenyl)-N-[(2-methox…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.38 2.11 -9.73 2 6 0 80 319.748 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3-fluorophenyl)-N-[(2-methoxy-4-pyridyl)methyl]oxamide N'-(3-fluorophenyl)-N-[(2-methox…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.87 1.65 -10.52 2 6 0 80 303.293 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-chloro-4-methyl-phenyl)-N'-[(2-methoxy-4-pyridyl)methyl]oxamide N-(3-chloro-4-methyl-phenyl)-N'-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 2.68 -9.81 2 6 0 80 333.775 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2-methoxy-4-pyridyl)methyl]-N'-[3-(trifluoromethyl)phenyl]oxamide N-[(2-methoxy-4-pyridyl)methyl]-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.60 2.6 -10.75 2 6 0 80 353.3 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,6-diisopropylphenyl)-N'-[(2-methoxy-4-pyridyl)methyl]oxamide N-(2,6-diisopropylphenyl)-N'-[(2…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.78 5.67 -8.23 2 6 0 80 369.465 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-fluorophenyl)-N-[(2-methoxy-4-pyridyl)methyl]oxamide N'-(2-fluorophenyl)-N-[(2-methox…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.85 1.69 -9.03 2 6 0 80 303.293 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-chloro-2-methyl-phenyl)-N'-[(2-methoxy-4-pyridyl)methyl]oxamide N-(3-chloro-2-methyl-phenyl)-N'-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.76 2.87 -8.03 2 6 0 80 333.775 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2,4-dichlorophenyl)-N-[(2-methoxy-4-pyridyl)methyl]oxamide N'-(2,4-dichlorophenyl)-N-[(2-me…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 2.72 -7.14 2 6 0 80 354.193 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2-methoxy-4-pyridyl)methyl]-N'-(2,3,4,5,6-pentafluorophenyl)oxamide N-[(2-methoxy-4-pyridyl)methyl]-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.26 1.99 -7.93 2 6 0 80 375.253 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-chloro-4-methyl-phenyl)-N'-[(2-methoxy-4-pyridyl)methyl]oxamide N-(2-chloro-4-methyl-phenyl)-N'-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 2.87 -8.07 2 6 0 80 333.775 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,4-dimethylphenyl)-N'-[(2-methoxy-4-pyridyl)methyl]oxamide N-(2,4-dimethylphenyl)-N'-[(2-me…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.55 3.14 -8.81 2 6 0 80 313.357 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(4-cyanophenyl)-N-[(2-methoxy-4-pyridyl)methyl]oxamide N'-(4-cyanophenyl)-N-[(2-methoxy…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.49 1.98 -11.28 2 7 0 104 310.313 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2-methoxy-4-pyridyl)methyl]-N'-(2,3,4-trifluorophenyl)oxamide N-[(2-methoxy-4-pyridyl)methyl]-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 1.82 -9.07 2 6 0 80 339.273 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-bromo-3-methyl-phenyl)-N'-[(2-methoxy-4-pyridyl)methyl]oxamide N-(4-bromo-3-methyl-phenyl)-N'-[…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.92 2.77 -8.57 2 6 0 80 378.226 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(2-chloro-4-fluoro-phenyl)-N-[(2-methoxy-4-pyridyl)methyl]oxamide N'-(2-chloro-4-fluoro-phenyl)-N-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.50 2.28 -7.45 2 6 0 80 337.738 5 ↓

Parameters Provided:

ring.id = 26998
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 = 26998 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?ring.id=26998&filter.purchasability=annotated

Embed Link to Results