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• Synonyms (0)
• Vendors (1)
• Annotations (1)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (9)

ZINC39913372

• 39913372

Physical Representations

Activity (Go SEA)

• 10233094
  

  Analogs

  38715226

  

  38715227

  

  39912742

  

  39912743

  

  39912896

  

  Popular Name: chloro-(4-chlorophenyl)-dimethyl-BLAHdione chloro-(4-chlorophenyl)-dimethyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 5660653

  • Enamine

    • Z339023778

  • Innovapharm

    • STT-00281285

  • Life Chemicals

    • F3227-0685

  • Mcule

    • MCULE-2567044129

  And 7 More

  Draw Identity 99% 90% 80% 70%

  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)	4.55	1.99	-8.42	0	4	0	50	374.223	1	↓ MOL2 SDF SMILES Flexibase

  More about ZINC10233094
• 10233093
  

  Analogs

  10233094

  

  16778784

  

  16778786

  

  38715226

  

  38715227

  

  Popular Name: chloro-(4-chlorophenyl)-dimethyl-BLAHdione chloro-(4-chlorophenyl)-dimethyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 5660653

  • Enamine

    • Z339023778

  • Innovapharm

    • STT-00281285

  • Life Chemicals

    • F3227-0685

  • Mcule

    • MCULE-2567044129

  And 7 More

  Draw Identity 99% 90% 80% 70%

  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)	4.55	1.98	-8.52	0	4	0	50	374.223	1	↓ MOL2 SDF SMILES Flexibase

  More about ZINC10233093
• 2329984
  

  Analogs

  39913370

  

  39913372

  

  39913373

  

  39913374

  

  39913375

  

  Popular Name: (1S)-2-allyl-7-chloro-1-(3-hydroxyphenyl)-6-methyl-1H-chromeno[2,3-c]pyrrole-3,9-quinone (1S)-2-allyl-7-chloro-1-(3-hydro…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Vitas-M

    • STK595190

  • eMolecules

    • 4684431

  • Enamine

    • Z57908406

  • IBScreen

    • STOCK5S-49309

  • Innovapharm

    • STT-00148582

  And 9 More

  Draw Identity 99% 90% 80% 70%

  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)	4.01	0.89	-10.11	1	5	0	70	381.815	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC02329984
• 2329985
  

  Analogs

  39913370

  

  39913372

  

  39913373

  

  39913374

  

  39913375

  

  Popular Name: (1R)-2-allyl-7-chloro-1-(3-hydroxyphenyl)-6-methyl-1H-chromeno[2,3-c]pyrrole-3,9-quinone (1R)-2-allyl-7-chloro-1-(3-hydro…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Vitas-M

    • STK595190

  • eMolecules

    • 4684431

  • Enamine

    • Z57908406

  • IBScreen

    • STOCK5S-49309

  • Innovapharm

    • STT-00148582

  And 9 More

  Draw Identity 99% 90% 80% 70%

  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)	4.01	0.68	-9.17	1	5	0	70	381.815	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC02329985
• 10233090
  

  Analogs

  16778784

  

  16778786

  

  38715158

  

  38715159

  

  39912754

  

  Popular Name: chloro-dimethyl-(p-tolyl)BLAHdione chloro-dimethyl-(p-tolyl)BLAHdione

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 5660649

  • Enamine

    • Z339023768

  • Innovapharm

    • STT-00281284

  • Life Chemicals

    • F3227-0678

  • Mcule

    • MCULE-2097033188

  And 7 More

  Draw Identity 99% 90% 80% 70%

  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)	4.32	2.46	-8.6	0	4	0	50	353.805	1	↓ MOL2 SDF SMILES Flexibase

  More about ZINC10233090
• 10233089
  

  Analogs

  10233090

  

  16778784

  

  16778786

  

  38715158

  

  38715159

  

  Popular Name: chloro-dimethyl-(p-tolyl)BLAHdione chloro-dimethyl-(p-tolyl)BLAHdione

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 5660649

  • Enamine

    • Z339023768

  • Innovapharm

    • STT-00281284

  • Life Chemicals

    • F3227-0678

  • Mcule

    • MCULE-2097033188

  And 7 More

  Draw Identity 99% 90% 80% 70%

  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)	4.32	2.45	-8.62	0	4	0	50	353.805	1	↓ MOL2 SDF SMILES Flexibase

  More about ZINC10233089
• 10233084
  

  Analogs

  38714785

  

  38714787

  

  39912818

  

  39912819

  

  39912988

  

  Popular Name: chloro-(4-chlorophenyl)-(3-dimethylaminopropyl)-methyl-BLAHdione chloro-(4-chlorophenyl)-(3-dimet…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 5660643

  • Innovapharm

    • STT-00281226

  • Life Chemicals

    • F3227-0580

  • Mcule

    • MCULE-4560191735

  • Otava

    • 1005027

  And 6 More

  Draw Identity 99% 90% 80% 70%

  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)	4.85	2.66	-42.52	1	5	1	54	446.354	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC10233084
• 10233083
  

  Analogs

  10233084

  

  38714785

  

  38714787

  

  39912818

  

  39912819

  

  Popular Name: chloro-(4-chlorophenyl)-(3-dimethylaminopropyl)-methyl-BLAHdione chloro-(4-chlorophenyl)-(3-dimet…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 5660643

  • Innovapharm

    • STT-00281226

  • Life Chemicals

    • F3227-0580

  • Mcule

    • MCULE-4560191735

  • Otava

    • 1005027

  And 6 More

  Draw Identity 99% 90% 80% 70%

  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)	4.85	2.84	-44.23	1	5	1	54	446.354	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC10233083
• 16778786
  

  Analogs

  16806468

  

  16806470

  

  39912742

  

  39912743

  

  39912744

  

  Popular Name: (1R)-7-chloro-2-(2-hydroxyethyl)-6-methyl-1-phenyl-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-7-chloro-2-(2-hydroxyethyl)…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Innovapharm

    • STT-00190243

  • Innovapharm Make-on-Demand

    • VT-00224415

  • TimTec Make-on-Demand

    • ST50165949

  • PubChem

    • 51567605
    • 16443403

  Draw Identity 99% 90% 80% 70%

  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)	3.24	7.51	-9.57	1	5	0	71	369.804	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16778786