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

Analogs

41195324
41195324
41195327
41195327
41195330
41195330
41192161
41192161
41192164
41192164

Draw Identity 99% 90% 80% 70%

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) 4.79 9.88 -37.54 2 2 1 29 301.479 6
Mid Mid (pH 6-8) 4.79 8.87 -6.11 1 2 0 25 300.471 6
Lo Low (pH 4.5-6) 4.79 10.25 -100 3 2 2 31 302.487 6

Analogs

41195327
41195327
41195330
41195330
41192161
41192161
41192164
41192164
41192167
41192167

Draw Identity 99% 90% 80% 70%

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) 4.79 9.78 -31.52 2 2 1 29 301.479 6
Mid Mid (pH 6-8) 4.79 8.95 -4.59 1 2 0 25 300.471 6
Lo Low (pH 4.5-6) 4.79 10.2 -97.69 3 2 2 31 302.487 6

Analogs

41195330
41195330
41192161
41192161
41192164
41192164
41192167
41192167
41192170
41192170

Draw Identity 99% 90% 80% 70%

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) 4.79 9.75 -31.54 2 2 1 29 301.479 6
Mid Mid (pH 6-8) 4.79 8.83 -5.07 1 2 0 25 300.471 6
Lo Low (pH 4.5-6) 4.79 10.17 -97.79 3 2 2 31 302.487 6

Analogs

41192161
41192161
41192164
41192164
41192167
41192167
41192170
41192170
41195321
41195321

Draw Identity 99% 90% 80% 70%

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) 4.79 9.89 -36.61 2 2 1 29 301.479 6
Mid Mid (pH 6-8) 4.79 8.69 -7 1 2 0 25 300.471 6
Lo Low (pH 4.5-6) 4.79 10.01 -96.38 3 2 2 31 302.487 6

Analogs

41191845
41191845
41191848
41191848

Draw Identity 99% 90% 80% 70%

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) 3.99 9.33 -38.57 2 2 1 29 287.452 6
Mid Mid (pH 6-8) 3.99 8.64 -4.37 1 2 0 25 286.444 6
Lo Low (pH 4.5-6) 3.99 9.75 -102.88 3 2 2 31 288.46 6

Analogs

41191845
41191845
41191848
41191848

Draw Identity 99% 90% 80% 70%

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) 3.99 9.53 -32.56 2 2 1 29 287.452 6
Mid Mid (pH 6-8) 3.99 8.51 -5.01 1 2 0 25 286.444 6
Lo Low (pH 4.5-6) 3.99 9.92 -100.43 3 2 2 31 288.46 6

Analogs

41197706
41197706

Draw Identity 99% 90% 80% 70%

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) 3.79 9.09 -35.35 2 2 1 29 287.452 5
Mid Mid (pH 6-8) 3.79 8.28 -5.97 1 2 0 25 286.444 5

Analogs

41197704
41197704

Draw Identity 99% 90% 80% 70%

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) 3.79 9.29 -30.06 2 2 1 29 287.452 5
Mid Mid (pH 6-8) 3.79 8.39 -4.15 1 2 0 25 286.444 5

Analogs

41197830
41197830
41197832
41197832
41197834
41197834
41201304
41201304
41201307
41201307

Draw Identity 99% 90% 80% 70%

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) 4.59 9.62 -34.59 2 2 1 29 301.479 5
Mid Mid (pH 6-8) 4.59 9.2 -5.31 1 2 0 25 300.471 5

Analogs

41197832
41197832
41197834
41197834
41201304
41201304
41201307
41201307
41201310
41201310

Draw Identity 99% 90% 80% 70%

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) 4.59 9.61 -30.12 2 2 1 29 301.479 5
Mid Mid (pH 6-8) 4.59 8.65 -4.44 1 2 0 25 300.471 5

Analogs

41197834
41197834
41201304
41201304
41201307
41201307
41201310
41201310
41201313
41201313

Draw Identity 99% 90% 80% 70%

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) 4.59 9.51 -29.02 2 2 1 29 301.479 5
Mid Mid (pH 6-8) 4.59 8.47 -5.85 1 2 0 25 300.471 5

Analogs

41201304
41201304
41201307
41201307
41201310
41201310
41201313
41201313
41197828
41197828

Draw Identity 99% 90% 80% 70%

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) 4.59 9.56 -33.58 2 2 1 29 301.479 5
Mid Mid (pH 6-8) 4.59 9.93 -3.45 1 2 0 25 300.471 5