UCSF

ZINC66124485

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 19th, 2011 42 No

Popular Name: (5R)-1-[[(2S)-1-[(2R)-2-[(4R)-4-benzyl-3-(3-cyclopentylpropyl)-2-imino-imidazolidin-1-yl]-3-methyl-b (5R)-1-[[(2S)-1-[(2R)-2-[(4R)-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) 6.40 20.5 -197.14 6 7 3 80 580.93 14 ↓
Hi High (pH 8-9.5) 6.40 20.96 -77.47 5 7 2 79 579.922 14 ↓

Activity (Go SEA)

Rings

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

No pre-computed analogs available. Try a structural similarity search.