UCSF

ZINC29056149

Substance Information

In ZINC since Heavy atoms Benign functionality
March 10th, 2009 19 No

Other Names:

Xanomeline (oxalate)

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) 3.79 6.61 -39.61 1 4 1 39 282.433 7
Hi High (pH 8-9.5) 3.79 4.14 -3.03 0 4 0 38 281.425 7

Activity (Go SEA)

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