UCSF

ZINC67473247

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2011 26 Yes

Popular Name: 3-(3-methoxyphenyl)-5-[3-(3-pyridyl)propyl]-6,7-dihydro-4H-isoxazolo[4,5-c]pyridine 3-(3-methoxyphenyl)-5-[3-(3-pyri…

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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) 3.22 10.23 -51.96 1 5 1 53 350.442 6 ↓
Mid Mid (pH 6-8) 3.22 7.97 -11.18 0 5 0 51 349.434 6 ↓
Lo Low (pH 4.5-6) 3.22 10.7 -103.89 2 5 2 54 351.45 6 ↓

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

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