UCSF

ZINC00038942

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 23 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) 4.95 2.27 -13.17 0 3 0 39 302.329 2

Vendor Notes

Note Type Comments Provided By
M.P. 164-165 C Indofine
MP 164-165o C Indofine
APPEARANCE Off white crystals Indofine
SOLUBILITY Soluble in Acetone Indofine

Activity (Go SEA)

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