UCSF

ZINC03995578

Annotations

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) -2.28 1.3 -40.66 3 3 0 68 115.132 1
Hi High (pH 8-9.5) 1.86 7.28 -11.09 0 3 0 31 179.267 0

Vendor Notes

Note Type Comments Provided By
MP 226 TCI
MP 239 - 241 Enamine Building Blocks
MP 239...241 Enamine Building Blocks
MP 261 - 263 Enamine Building Blocks
MP 261...263 Enamine Building Blocks
Melting_Point 261? lit. Alfa-Aesar
MP 261°(dec.) Oakwood Chemical
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Fluorochem
Warnings IRRITANT Matrix Scientific
Therapy NMDA receptor antagonist SMDC MicroSource

Activity (Go SEA)

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

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