UCSF

ZINC36455559

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2009 9 Yes

Popular Name: (3S)-3-hydroxy-4,4-dimethyl-pentanenitrile (3S)-3-hydroxy-4,4-dimethyl-pent…

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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) 0.83 2.07 -8.21 1 2 0 44 127.187 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US5292621 IBM Patent Data

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