UCSF

ZINC65499741

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 24 No

Popular Name: (2R,4S)-1-[[(4R)-3-(2,5-dimethylphenyl)-4H-pyrazol-4-yl]methyl]-4-hydroxy-piperidine-2-carboxylic (2R,4S)-1-[[(4R)-3-(2,5-dimethyl…

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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) -0.06 6.35 -50 2 6 0 90 329.4 4 ↓
Mid Mid (pH 6-8) -0.06 4.26 -57.09 1 6 -1 88 328.392 4 ↓

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

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