UCSF

ZINC26424061

Substance Information

In ZINC since Heavy atoms Benign functionality
February 6th, 2009 17 Yes

Other Names:

F2182-0080

MFCD11987000

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) 3.41 7.52 -45.53 2 3 1 29 270.809 4
Hi High (pH 8-9.5) 3.41 5 -7.25 1 3 0 28 269.801 4

Activity (Go SEA)

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