UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 2-chloro-4-(3-methylpyrazol-1-yl)quinazoline 2-chloro-4-(3-methylpyrazol-1-yl…

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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) 3.03 7.48 -8.93 0 4 0 44 244.685 1 ↓

Analogs

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Popular Name: 2-chloro-4-(3-isopropylpyrazol-1-yl)quinazoline 2-chloro-4-(3-isopropylpyrazol-1…

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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) 4.08 8.75 -8.2 0 4 0 44 272.739 2 ↓

Analogs

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Popular Name: 4-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(trifluoromethyl)quinazoline 4-(3,5-dimethyl-1H-pyrazol-1-yl)…

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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) 3.25 8.44 -10.16 0 4 0 44 292.264 2 ↓

Analogs

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Popular Name: 1-(6-aminoquinazolin-4-yl)-N-methyl-pyrazole-3-carboxamide 1-(6-aminoquinazolin-4-yl)-N-met…

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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) 0.29 3.22 -11.92 3 7 0 99 268.28 2 ↓

Analogs

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Popular Name: 1-(6-aminoquinazolin-4-yl)-N,N-dimethyl-pyrazole-3-carboxamide 1-(6-aminoquinazolin-4-yl)-N,N-d…

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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) 0.54 5.14 -12.7 2 7 0 90 282.307 2 ↓

Analogs

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Popular Name: 4-(3-carbamoylpyrazol-1-yl)quinazoline-7-carboxylic 4-(3-carbamoylpyrazol-1-yl)quina…

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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) 0.75 4.4 -47.63 2 8 -1 127 282.239 3 ↓

Analogs

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Popular Name: 4-(3-carbamoylpyrazol-1-yl)quinazoline-2-carboxylic 4-(3-carbamoylpyrazol-1-yl)quina…

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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) 0.54 3.8 -57.19 2 8 -1 127 282.239 3 ↓

Analogs

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Popular Name: 1-(2-chloroquinazolin-4-yl)-N-methyl-pyrazole-3-carboxamide 1-(2-chloroquinazolin-4-yl)-N-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) 2.24 5.15 -10.69 1 6 0 73 287.71 2 ↓

Analogs

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Popular Name: 1-(2-chloroquinazolin-4-yl)-N,N-dimethyl-pyrazole-3-carboxamide 1-(2-chloroquinazolin-4-yl)-N,N-…

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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) 2.48 7.07 -11.48 0 6 0 64 301.737 2 ↓

Analogs

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Popular Name: 4-(4-carbamoylpyrazol-1-yl)quinazoline-7-carboxylic 4-(4-carbamoylpyrazol-1-yl)quina…

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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) 0.44 4.42 -52.69 2 8 -1 127 282.239 3 ↓

Analogs

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Popular Name: 4-(4-carbamoylpyrazol-1-yl)quinazoline-2-carboxylic 4-(4-carbamoylpyrazol-1-yl)quina…

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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) 0.23 3.83 -66.73 2 8 -1 127 282.239 3 ↓

Parameters Provided:

ring.id = 28574
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 = 28574 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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