UCSF

ZINC01669521

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 18 Yes

Popular Name: Tripropionin Tripropionin

Find On: PubMed — Wikipedia — Google

CAS Numbers: 139-45-7 , [139-45-7]

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) 1.60 4.39 -11.13 0 6 0 79 260.286 11 ↓

Vendor Notes

Note Type Comments Provided By
Molecular_Solubility 1.987 Bitter DB
BP [°C] 151 (p=2 torr) Acros Organics
BP 176 / 20 TCI
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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