UCSF

ZINC02382373

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 10 Yes

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) 2.35 0.98 -6.9 1 1 0 20 144.12 0

Vendor Notes

Note Type Comments Provided By
Melting_Point 35-38? Alfa-Aesar
MP 35-38° Matrix Scientific
Warnings Corrosive Matrix Scientific
Warnings TOXIC Matrix Scientific

Activity (Go SEA)

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

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