UCSF

ZINC01707332

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2005 16 No

Popular Name: NF NF

Find On: PubMed — Wikipedia — Google

CAS Number: 125-42-8

Download: MOL2 SDF SMILES Flexibase

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) 1.81 1.34 -4.99 2 5 0 75 224.26 3 ↓

Vendor Notes

Note Type Comments Provided By
Molecular_Solubility 2.296 Bitter DB
PUBCHEM_PATENT_ID EP0216247A2; US3950423; US3978127; US3988454; US4020096; US4046894; US4071570; US4249005; US4339454; US4673680 IBM Patent Data

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