UCSF

ZINC00165735

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) 0.92 2.9 -7.54 1 3 0 42 125.127 2

Vendor Notes

Note Type Comments Provided By
MP 72-74° Matrix Scientific
MP 73 TCI
Melting_Point 74-78? Alfa-Aesar
MP 74-78° Oakwood Chemical
purity 9.500000000000000e+001 Enamine Building Blocks
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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