UCSF

ZINC19258065

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2008 18 Yes

Other Names:

MFCD09741523

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) 1.63 3.9 -54.62 3 4 1 65 269.39 3
Hi High (pH 8-9.5) 1.63 3.5 -8.76 2 4 0 63 268.382 3

Activity (Go SEA)

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