UCSF

ZINC34932608

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 35 No

Popular Name: (4Z,5S)-5-(3-butoxyphenyl)-4-[(4-chlorophenyl)-hydroxy-methylene]-1-(2-morpholinoethyl)pyrrolidine-2 (4Z,5S)-5-(3-butoxyphenyl)-4-[(4…

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) 4.40 9.35 -54.45 0 7 -1 82 497.999 10 ↓
Mid Mid (pH 6-8) 4.40 11.61 -68.49 1 7 0 83 499.007 10 ↓
Lo Low (pH 4.5-6) 4.40 10.86 -52.89 2 7 1 81 500.015 10 ↓

Activity (Go SEA)

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