UCSF

ZINC04252596

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2005 20 No

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) 3.95 1.84 -9.02 1 3 0 46 272.275 4

Vendor Notes

Note Type Comments Provided By
MP 125.6-127.4o C Indofine
M.P. 126-127 C Indofine
APPEARANCE Orange colored shining powder Indofine
SOLUBILITY Soluble in Chloroform Indofine

Activity (Go SEA)

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