UCSF

ZINC04349637

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2005 21 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) 3.77 -0.59 -11.96 2 4 0 70 282.295 1

Vendor Notes

Note Type Comments Provided By
M.P. 207 C Indofine
MP 207o C Indofine

Activity (Go SEA)

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