Warning: session_write_close() [function.session-write-close]: open(/tmp/session/sess_6tdtjdnmsismersuuvk26iuhe0, 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: 2-[(2S,6R)-2,6-dimethylpiperazine-1-carbonyl]chromen-4-one 2-[(2S,6R)-2,6-dimethylpiperazin…

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) 1.45 5.14 -56.49 2 5 1 67 287.339 1 ↓
Mid Mid (pH 6-8) 1.45 3.86 -9.54 1 5 0 63 286.331 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S,6S)-2,6-dimethylpiperazine-1-carbonyl]chromen-4-one 2-[(2S,6S)-2,6-dimethylpiperazin…

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) 1.45 5.88 -58.4 2 5 1 67 287.339 1 ↓
Mid Mid (pH 6-8) 1.45 4.56 -10.63 1 5 0 63 286.331 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2R,6R)-2,6-dimethylpiperazine-1-carbonyl]chromen-4-one 2-[(2R,6R)-2,6-dimethylpiperazin…

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) 1.45 5.9 -56.56 2 5 1 67 287.339 1 ↓
Mid Mid (pH 6-8) 1.45 4.53 -11.13 1 5 0 63 286.331 1 ↓

Analogs

8132421
8132421

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-methylpiperazine-1-carbonyl)chromen-4-one 2-(4-methylpiperazine-1-carbonyl…

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) 1.39 4.47 -10.76 0 5 0 54 272.304 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[4-[(2S)-2-hydroxybutyl]piperazine-1-carbonyl]chromen-4-one 2-[4-[(2S)-2-hydroxybutyl]pipera…

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) 1.62 3.49 -12.5 1 6 0 74 330.384 4 ↓
Lo Low (pH 4.5-6) 1.62 5.7 -54.31 2 6 1 75 331.392 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[4-[(2R)-2-hydroxybutyl]piperazine-1-carbonyl]chromen-4-one 2-[4-[(2R)-2-hydroxybutyl]pipera…

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) 1.62 3.59 -11.42 1 6 0 74 330.384 4 ↓
Lo Low (pH 4.5-6) 1.62 5.85 -51.1 2 6 1 75 331.392 4 ↓