UCSF

ZINC19883559

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 25 No

Popular Name: (5R)-1-(2-dimethylaminoethyl)-4-(furan-2-carbonyl)-3-hydroxy-5-(5-methyl-2-furyl)-5H-pyrrol-2-one (5R)-1-(2-dimethylaminoethyl)-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) 1.14 6.64 -72.84 1 7 0 91 344.367 6 ↓
Hi High (pH 8-9.5) 1.14 4.11 -60.7 0 7 -1 90 343.359 6 ↓
Lo Low (pH 4.5-6) 1.14 5.82 -48.44 2 7 1 88 345.375 6 ↓

Activity (Go SEA)

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