UCSF

ZINC59416995

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 4th, 2011 22 Yes

Popular Name: N,N-dimethyl-4-[(2R,5R)-5-(2-pyridylsulfanylmethyl)oxazolidin-2-yl]aniline N,N-dimethyl-4-[(2R,5R)-5-(2-pyr…

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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) 2.92 4.94 -7.49 1 4 0 37 315.442 5 ↓
Mid Mid (pH 6-8) 2.92 6.84 -46.55 2 4 1 42 316.45 5 ↓
Lo Low (pH 4.5-6) 2.92 5.67 -22.11 2 4 0 39 316.45 5 ↓

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

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