UCSF

ZINC00057735

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 13 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) 2.85 1.99 -10.47 0 2 0 30 194.617 0

Vendor Notes

Note Type Comments Provided By
Melting_Point 169-172? Alfa-Aesar
Melting_Point 169-172° Alfa-Aesar
M.P. 170-171 C Indofine
MP 170-171o C Indofine
APPEARANCE Pale white colored powder Indofine
SOLUBILITY Soluble in Chloroform Indofine

Activity (Go SEA)

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

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