UCSF

ZINC01851023

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 13 No

Popular Name: Linalyl formate Linalyl formate

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CAS Number: 115-99-1

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) 3.64 3.95 -7.35 0 2 0 26 182.263 6 ↓

Vendor Notes

Note Type Comments Provided By
Molecular_Solubility 3.126 Bitter DB

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