UCSF

ZINC39696889

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 3rd, 2010 35 Yes

Popular Name: (1S)-3-(4-chloro-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carbonyl)-N-[[(2R)-4-methylmorpholin-2-yl]me (1S)-3-(4-chloro-1,3-dimethyl-py…

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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) -0.32 3.31 -61.66 3 10 1 109 505.043 4 ↓
Mid Mid (pH 6-8) -0.32 5.74 -114.25 4 10 2 110 506.051 4 ↓

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