UCSF

ZINC09042850

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2007 33 No

Popular Name: 5-(3-allyloxyphenyl)-4-[hydroxy-(5-methyl-2-furyl)-methylene]-1-(2-morpholinoethyl)pyrrolidine-2,3-d 5-(3-allyloxyphenyl)-4-[hydroxy-…

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) 2.41 6.26 -59.19 0 8 -1 95 451.499 9 ↓
Mid Mid (pH 6-8) 2.86 9.21 -43.19 2 8 1 94 453.515 8 ↓
Mid Mid (pH 6-8) 2.41 8.66 -68 1 8 0 96 452.507 9 ↓

Activity (Go SEA)

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