UCSF

ZINC33775443

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2009 39 No

Popular Name: (4Z,5R)-5-(4-benzyloxy-3-methoxy-phenyl)-4-[hydroxy(4-pyridyl)methylene]-1-(2-morpholinoethyl)pyrrol (4Z,5R)-5-(4-benzyloxy-3-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) 2.21 8.83 -55.36 0 9 -1 104 528.585 10 ↓
Mid Mid (pH 6-8) 2.21 11.17 -70.8 1 9 0 105 529.593 10 ↓
Lo Low (pH 4.5-6) 2.21 9.88 -62.29 2 9 1 103 530.601 10 ↓

Activity (Go SEA)

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