UCSF

ZINC02566161

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 25 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) 2.23 -1.14 -13.78 2 7 0 94 346.335 4

Vendor Notes

Note Type Comments Provided By
M.P. 227-230 C Indofine
MP 227-230o C Indofine

Activity (Go SEA)

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