UCSF

ZINC03981717

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2005 26 Yes

Popular Name: CC[C@H](C)[C@@H](C(=O)OCC)NC(=O)CCCCCCCCCCCOC CC[C@H](C)[C@@H](C(=O)OCC)NC(=O)…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 5.84 11.36 -6.88 1 5 0 65 371.562 18 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US5952377 IBM Patent Data

Activity (Go SEA)

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