UCSF

ZINC01687490

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 16 Yes

Popular Name: Diisopropyl adipate Diisopropyl adipate

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CAS Numbers: 6938-94-9 , [6938-94-9]

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) 2.45 3.93 -7.79 0 4 0 52 230.304 9 ↓

Vendor Notes

Note Type Comments Provided By
MP 1 TCI
BP 120 / 6.5 TCI

Activity (Go SEA)

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