UCSF

ZINC00057585

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 Yes

Popular Name: Dillapiole Dillapiole

Find On: PubMed — Wikipedia — Google

CAS Number: 484-31-1

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) 2.62 1.97 -6.77 0 4 0 36 222.24 4 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4803290; US4876277; WO2000056911A1 IBM Patent Data

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