UCSF

ZINC23367344

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 30th, 2008 25 Yes

Popular Name: 6-(difluoromethyl)-2-[2-[(2,2-dimethylmorpholin-4-yl)methyl]phenyl]-3H-pyrimidin-4-one 6-(difluoromethyl)-2-[2-[(2,2-di…

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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) 2.98 5.83 -10.15 1 5 0 58 349.381 4 ↓
Mid Mid (pH 6-8) 3.44 4.95 -44.45 0 5 -1 61 348.373 4 ↓
Lo Low (pH 4.5-6) 2.98 7.53 -40.9 2 5 1 59 350.389 4 ↓

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

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