UCSF

ZINC01718570

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 11 Yes

Popular Name: CYCLOHEXYL PROPIONATE CYCLOHEXYL PROPIONATE

Find On: PubMed — Wikipedia — Google

CAS Number: 6222-35-1

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) 2.65 1.9 -4.84 0 2 0 26 156.225 3 ↓

Vendor Notes

Note Type Comments Provided By
BP 193 TCI
PUBCHEM_PATENT_ID US4473487 IBM Patent Data

Activity (Go SEA)

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