UCSF

ZINC65505473

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 23 No

Popular Name: (3R)-1-(2-methoxyethyl)-N-methyl-N-[[(3S)-4,5,6,7-tetrahydro-3H-indazol-3-yl]methyl]pyrrolidine-3-ca (3R)-1-(2-methoxyethyl)-N-methyl…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 1.88 5.53 -40.43 1 6 1 59 321.445 6 ↓
Mid Mid (pH 6-8) 1.88 3.09 -15.39 0 6 0 58 320.437 6 ↓

Activity (Go SEA)

Rings

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

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