UCSF

ZINC00966674

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) 1.73 3.95 -3.47 0 1 0 13 172.025 0
Lo Low (pH 4.5-6) 1.73 4.21 -29.3 1 1 1 14 173.033 0

Vendor Notes

Note Type Comments Provided By
MP 32 - 34 Enamine Building Blocks
MP 32 - 36 Enamine Building Blocks
Melting_Point 32-36? Alfa-Aesar
MP 32-36° Matrix Scientific
MP 32...36 Enamine Building Blocks
MP 36 TCI
BP 74 / 17 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% APIChem
Purity 98% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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