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Analogs

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Popular Name: (3E)-6-bromo-3-(3-pyridylmethylene)chroman-4-one (3E)-6-bromo-3-(3-pyridylmethyle…

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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) 2.99 7.13 -8.41 0 3 0 39 316.154 1 ↓

Analogs

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Popular Name: (3E)-8-bromo-3-(3-pyridylmethylene)chroman-4-one (3E)-8-bromo-3-(3-pyridylmethyle…

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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) 2.96 7.2 -8.28 0 3 0 39 316.154 1 ↓

Analogs

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Popular Name: (3Z)-8-bromo-3-(3-pyridylmethylene)chroman-4-one (3Z)-8-bromo-3-(3-pyridylmethyle…

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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) 2.96 7.3 -9.46 0 3 0 39 316.154 1 ↓

Analogs

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Popular Name: (3E)-8-methyl-3-(3-pyridylmethylene)chroman-4-one (3E)-8-methyl-3-(3-pyridylmethyl…

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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) 2.60 7.27 -8.95 0 3 0 39 251.285 1 ↓

Analogs

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Popular Name: (3Z)-8-methyl-3-(3-pyridylmethylene)chroman-4-one (3Z)-8-methyl-3-(3-pyridylmethyl…

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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) 2.60 7.36 -10.18 0 3 0 39 251.285 1 ↓

Analogs

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Popular Name: (3E)-8-methoxy-3-(3-pyridylmethylene)chroman-4-one (3E)-8-methoxy-3-(3-pyridylmethy…

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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) 2.02 6.46 -10.36 0 4 0 48 267.284 2 ↓

Analogs

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Popular Name: (3Z)-8-methoxy-3-(3-pyridylmethylene)chroman-4-one (3Z)-8-methoxy-3-(3-pyridylmethy…

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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) 2.02 6.55 -11.41 0 4 0 48 267.284 2 ↓

Analogs

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Popular Name: (3E)-5,7-dimethyl-3-(3-pyridylmethylene)chroman-4-one (3E)-5,7-dimethyl-3-(3-pyridylme…

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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) 3.00 7.86 -8.32 0 3 0 39 265.312 1 ↓

Analogs

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Popular Name: (3Z)-5,7-dimethyl-3-(3-pyridylmethylene)chroman-4-one (3Z)-5,7-dimethyl-3-(3-pyridylme…

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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) 3.00 7.96 -9.38 0 3 0 39 265.312 1 ↓

Analogs

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Popular Name: (3E)-7,8-dichloro-3-(3-pyridylmethylene)chroman-4-one (3E)-7,8-dichloro-3-(3-pyridylme…

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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) 3.46 7.55 -7.48 0 3 0 39 306.148 1 ↓

Analogs

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Popular Name: (3Z)-5,8-dimethyl-3-(3-pyridylmethylene)chroman-4-one (3Z)-5,8-dimethyl-3-(3-pyridylme…

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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) 3.00 8.05 -9.47 0 3 0 39 265.312 1 ↓

Analogs

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Popular Name: (3E)-5,8-dimethyl-3-(3-pyridylmethylene)chroman-4-one (3E)-5,8-dimethyl-3-(3-pyridylme…

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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) 3.00 7.94 -8.48 0 3 0 39 265.312 1 ↓

Analogs

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Popular Name: (3Z)-8-bromo-6-methyl-3-(3-pyridylmethylene)chroman-4-one (3Z)-8-bromo-6-methyl-3-(3-pyrid…

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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) 3.37 7.95 -9.23 0 3 0 39 330.181 1 ↓

Analogs

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Popular Name: (3Z)-6,8-dimethyl-3-(3-pyridylmethylene)chroman-4-one (3Z)-6,8-dimethyl-3-(3-pyridylme…

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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) 3.00 8.03 -10.17 0 3 0 39 265.312 1 ↓

Parameters Provided:

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Structural Results Found: (before additional filtering)

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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 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 = 146332 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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