UCSF

ZINC39500553

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 27th, 2010 25 No

Popular Name: 3-(3-oxo-4H-pyridazin-6-yl)-N-[(1S)-1-(2-phenyl-1,3-dihydropyrazol-4-yl)ethyl]propanamide 3-(3-oxo-4H-pyridazin-6-yl)-N-[(…

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Vendors

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) 1.27 5.15 -13.85 3 7 0 90 339.399 6 ↓
Hi High (pH 8-9.5) 1.73 3.18 -50.43 2 7 -1 93 338.391 6 ↓
Lo Low (pH 4.5-6) 1.27 5.33 -49.56 4 7 1 95 340.407 6 ↓

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

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