UCSF

ZINC05647776

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 8th, 2006 27 Yes

Popular Name: INN) INN)

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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) 3.35 -5.74 -47.65 3 6 1 74 396.577 7 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0077754A2; US4565818 IBM Patent Data

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