UCSF

ZINC00169105

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 17 Yes

Popular Name: methyl 1-(6-chloro-3-pyridazinyl)-4-piperidinecarboxylate methyl 1-(6-chloro-3-pyridazinyl…

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CAS Numbers: 339276-34-5 , [339276-34-5]

Download: MOL2 SDF SMILES Flexibase

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) 2.29 6.21 -12.82 0 5 0 55 255.705 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
MP 98-100° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.