UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-(cyclopropylmethyl)-4,6-dimethoxy-1,3,5-triazin-2-amine N-(cyclopropylmethyl)-4,6-dimeth…

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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) 2.34 0.43 -6.68 1 6 0 69 210.237 5 ↓

Analogs

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Popular Name: N-[(1S)-1-cyclopropylethyl]-4,6-dimethoxy-1,3,5-triazin-2-amine N-[(1S)-1-cyclopropylethyl]-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) 2.67 1.08 -6.57 1 6 0 69 224.264 5 ↓

Analogs

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Popular Name: N-[(1R)-1-cyclopropylethyl]-4,6-dimethoxy-1,3,5-triazin-2-amine N-[(1R)-1-cyclopropylethyl]-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) 2.67 1.2 -6.74 1 6 0 69 224.264 5 ↓

Analogs

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Popular Name: 4,6-dichloro-N-(cyclopropylmethyl)-N-ethyl-1,3,5-triazin-2-amine 4,6-dichloro-N-(cyclopropylmethy…

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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) 3.51 9.48 -3.77 0 4 0 42 247.129 4 ↓

Analogs

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Popular Name: 4-chloro-N-(cyclopropylmethyl)-N-ethyl-6-methoxy-1,3,5-triazin-2-amine 4-chloro-N-(cyclopropylmethyl)-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) 3.29 6.46 -5.52 0 5 0 51 242.71 5 ↓

Analogs

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Popular Name: 4-chloro-N-(cyclopropylmethyl)-N-ethyl-6-propoxy-1,3,5-triazin-2-amine 4-chloro-N-(cyclopropylmethyl)-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) 4.17 8.19 -4.76 0 5 0 51 270.764 7 ↓

Analogs

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Popular Name: 6-chloro-N4-(cyclopropylmethyl)-N2,N2,N4-triethyl-1,3,5-triazine-2,4-diamine 6-chloro-N4-(cyclopropylmethyl)-…

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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) 4.22 14.07 -5.79 0 5 0 45 283.807 7 ↓

Analogs

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Popular Name: 6-chloro-N2-(cyclopropylmethyl)-N2-ethyl-N4,N4-dimethyl-1,3,5-triazine-2,4-diamine 6-chloro-N2-(cyclopropylmethyl)-…

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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) 3.47 12.17 -6.38 0 5 0 45 255.753 5 ↓

Analogs

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Popular Name: 4-chloro-N-(cyclopropylmethyl)-N-ethyl-6-isopropoxy-1,3,5-triazin-2-amine 4-chloro-N-(cyclopropylmethyl)-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) 4.03 8.33 -5.38 0 5 0 51 270.764 6 ↓

Analogs

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Popular Name: 4-chloro-N-(cyclopropylmethyl)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine 4-chloro-N-(cyclopropylmethyl)-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) 3.66 7.4 -5.34 0 5 0 51 256.737 6 ↓

Parameters Provided:

ring.id = 217052
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 = 217052 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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