UCSF

ZINC62871596

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2011 19 Yes

Popular Name: 6-methyl-3-[(3R)-3-propyl-3-piperidyl]-[1,2,4]triazolo[3,4-f]pyridazine 6-methyl-3-[(3R)-3-propyl-3-pipe…

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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) 1.51 6.5 -48.39 2 5 1 60 260.365 3 ↓

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Rings

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

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