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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

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Popular Name: N-[(1R)-5-fluoroindan-1-yl]-4,6-dimethyl-pyrimidin-2-amine N-[(1R)-5-fluoroindan-1-yl]-4,6-…

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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) 3.26 9.47 -7.31 1 3 0 38 257.312 2 ↓
Lo Low (pH 4.5-6) 3.26 9.79 -31.27 2 3 1 39 258.32 2 ↓

Analogs

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Popular Name: N-[(1S)-5-fluoroindan-1-yl]-4,6-dimethyl-pyrimidin-2-amine N-[(1S)-5-fluoroindan-1-yl]-4,6-…

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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) 3.26 9.29 -7.42 1 3 0 38 257.312 2 ↓
Lo Low (pH 4.5-6) 3.26 9.6 -30.16 2 3 1 39 258.32 2 ↓

Analogs

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Popular Name: N-[(1R)-4-fluoroindan-1-yl]-4,6-dimethyl-pyrimidin-2-amine N-[(1R)-4-fluoroindan-1-yl]-4,6-…

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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) 3.23 9.48 -7.17 1 3 0 38 257.312 2 ↓
Lo Low (pH 4.5-6) 3.23 9.8 -31.83 2 3 1 39 258.32 2 ↓

Analogs

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Popular Name: N-[(1S)-4-fluoroindan-1-yl]-4,6-dimethyl-pyrimidin-2-amine N-[(1S)-4-fluoroindan-1-yl]-4,6-…

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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) 3.23 9.28 -6.95 1 3 0 38 257.312 2 ↓
Lo Low (pH 4.5-6) 3.23 9.6 -30.38 2 3 1 39 258.32 2 ↓

Analogs

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Popular Name: N-[(1R)-4-chloroindan-1-yl]-4,6-dimethyl-pyrimidin-2-amine N-[(1R)-4-chloroindan-1-yl]-4,6-…

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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) 3.75 9.89 -6.68 1 3 0 38 273.767 2 ↓
Lo Low (pH 4.5-6) 3.75 10.21 -30.67 2 3 1 39 274.775 2 ↓

Analogs

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Popular Name: N-[(1S)-4-chloroindan-1-yl]-4,6-dimethyl-pyrimidin-2-amine N-[(1S)-4-chloroindan-1-yl]-4,6-…

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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) 3.75 9.71 -6.47 1 3 0 38 273.767 2 ↓
Lo Low (pH 4.5-6) 3.75 10.02 -29.37 2 3 1 39 274.775 2 ↓

Analogs

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Popular Name: N-[(1R)-5-chloroindan-1-yl]-4-methoxy-pyrimidin-2-amine N-[(1R)-5-chloroindan-1-yl]-4-me…

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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) 3.29 7.15 -6.47 1 4 0 47 275.739 3 ↓
Lo Low (pH 4.5-6) 3.29 7.51 -35.28 2 4 1 48 276.747 3 ↓

Analogs

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Popular Name: N-[(1S)-5-chloroindan-1-yl]-4-methoxy-pyrimidin-2-amine N-[(1S)-5-chloroindan-1-yl]-4-me…

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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) 3.29 6.97 -6.43 1 4 0 47 275.739 3 ↓
Lo Low (pH 4.5-6) 3.29 7.33 -33.95 2 4 1 48 276.747 3 ↓

Analogs

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Popular Name: N-[(1R)-5-chloroindan-1-yl]-4,6-dimethyl-pyrimidin-2-amine N-[(1R)-5-chloroindan-1-yl]-4,6-…

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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) 3.77 9.91 -6.82 1 3 0 38 273.767 2 ↓
Lo Low (pH 4.5-6) 3.77 10.23 -30.36 2 3 1 39 274.775 2 ↓

Analogs

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Popular Name: N-[(1S)-5-chloroindan-1-yl]-4,6-dimethyl-pyrimidin-2-amine N-[(1S)-5-chloroindan-1-yl]-4,6-…

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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) 3.77 9.73 -6.93 1 3 0 38 273.767 2 ↓
Lo Low (pH 4.5-6) 3.77 10.05 -29.28 2 3 1 39 274.775 2 ↓

Analogs

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Popular Name: N-[(1R)-5-chloroindan-1-yl]pyrimidin-2-amine N-[(1R)-5-chloroindan-1-yl]pyrim…

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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) 2.89 8.7 -6.56 1 3 0 38 245.713 2 ↓

Analogs

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Popular Name: N-[(1S)-5-chloroindan-1-yl]pyrimidin-2-amine N-[(1S)-5-chloroindan-1-yl]pyrim…

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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) 2.89 8.52 -6.55 1 3 0 38 245.713 2 ↓

Analogs

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Popular Name: N-[(1R)-4-chloroindan-1-yl]-4-methoxy-pyrimidin-2-amine N-[(1R)-4-chloroindan-1-yl]-4-me…

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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) 3.27 7.13 -6.24 1 4 0 47 275.739 3 ↓
Lo Low (pH 4.5-6) 3.27 7.49 -35.6 2 4 1 48 276.747 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-4-chloroindan-1-yl]-4-methoxy-pyrimidin-2-amine N-[(1S)-4-chloroindan-1-yl]-4-me…

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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) 3.27 6.95 -6.01 1 4 0 47 275.739 3 ↓
Lo Low (pH 4.5-6) 3.27 7.3 -34.03 2 4 1 48 276.747 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-4-chloroindan-1-yl]pyrimidin-2-amine N-[(1S)-4-chloroindan-1-yl]pyrim…

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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) 2.87 8.69 -6.4 1 3 0 38 245.713 2 ↓

Analogs

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Popular Name: N-[(1R)-4-chloroindan-1-yl]pyrimidin-2-amine N-[(1R)-4-chloroindan-1-yl]pyrim…

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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) 2.87 8.42 -6.22 1 3 0 38 245.713 2 ↓

Analogs

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Popular Name: N-[(1R)-4-fluoroindan-1-yl]-4-methoxy-pyrimidin-2-amine N-[(1R)-4-fluoroindan-1-yl]-4-me…

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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) 2.75 6.72 -6.86 1 4 0 47 259.284 3 ↓
Lo Low (pH 4.5-6) 2.75 7.08 -36.91 2 4 1 48 260.292 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-4-fluoroindan-1-yl]-4-methoxy-pyrimidin-2-amine N-[(1S)-4-fluoroindan-1-yl]-4-me…

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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) 2.75 6.52 -6.55 1 4 0 47 259.284 3 ↓
Lo Low (pH 4.5-6) 2.75 6.88 -35.15 2 4 1 48 260.292 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-4-fluoroindan-1-yl]pyrimidin-2-amine N-[(1S)-4-fluoroindan-1-yl]pyrim…

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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) 2.35 8.26 -6.96 1 3 0 38 229.258 2 ↓

Analogs

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Popular Name: N-[(1R)-4-fluoroindan-1-yl]pyrimidin-2-amine N-[(1R)-4-fluoroindan-1-yl]pyrim…

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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) 2.35 7.99 -6.72 1 3 0 38 229.258 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-5-fluoroindan-1-yl]-4-methoxy-pyrimidin-2-amine N-[(1R)-5-fluoroindan-1-yl]-4-me…

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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) 2.78 6.71 -7.02 1 4 0 47 259.284 3 ↓
Lo Low (pH 4.5-6) 2.78 7.07 -36.27 2 4 1 48 260.292 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-5-fluoroindan-1-yl]-4-methoxy-pyrimidin-2-amine N-[(1S)-5-fluoroindan-1-yl]-4-me…

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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) 2.78 6.53 -6.94 1 4 0 47 259.284 3 ↓
Lo Low (pH 4.5-6) 2.78 6.88 -34.91 2 4 1 48 260.292 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-5-fluoroindan-1-yl]pyrimidin-2-amine N-[(1R)-5-fluoroindan-1-yl]pyrim…

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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) 2.38 8.26 -7.04 1 3 0 38 229.258 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-5-fluoroindan-1-yl]pyrimidin-2-amine N-[(1S)-5-fluoroindan-1-yl]pyrim…

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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) 2.38 8.08 -7.03 1 3 0 38 229.258 2 ↓

Parameters Provided:

ring.id = 254372
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 = 254372 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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