UCSF

ZINC01668943

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) 0.95 3.16 -49.98 3 4 1 55 226.296 5

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 4.79e-01 g/l DrugBank-experimental

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
5HT2C-3-E Serotonin 2c (5-HT2c) Receptor (cluster #3 Of 3), Eukaryotic Eukaryotes 5710 0.46 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
5HT2C_RAT P08909 Serotonin 2c (5-HT2c) Receptor, Rat 5710 0.46 Binding ≤ 10μM

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