UCSF

ZINC03642205

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 30 Yes

Popular Name: 1,2-Propanediol, 3-(p-(6-methoxy-2-phenyl-3,4-dihydro-1-naphthyl)phenoxy)-; 1-(p-(2,3-Dihydroxypropoxy)phenyl)-2-phenyl-6-methoxy-3,4-dihydronaphthalene; 3-(p-(6-Methoxy-2-phenyl-3,4-dihydro-1-naphthyl)phenoxy)-1,2-propanediol; BRN 2180120; LS-120563 1,2-Propanediol, 3-(p-(6-methoxy…

Find On: PubMed — Wikipedia — Google

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) 4.42 8.04 -11.76 2 4 0 59 402.49 7 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0833624A2; WO1988006292A1; WO1988008537A1; WO1996040098A2 IBM Patent Data

Activity (Go SEA)

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