UCSF

ZINC67955723

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 27 Yes

Popular Name: (3R)-3-[2-[4-(4-ethyl-1H-pyrazol-5-yl)-1-piperidyl]-2-oxo-ethyl]-5-methyl-indolin-2-one (3R)-3-[2-[4-(4-ethyl-1H-pyrazol…

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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) 2.41 9.09 -16.26 2 6 0 78 366.465 4 ↓
Mid Mid (pH 6-8) 2.41 9.11 -16.98 2 6 0 78 366.465 4 ↓
Mid Mid (pH 6-8) 2.41 9.11 -17.13 2 6 0 78 366.465 4 ↓

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

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