UCSF

ZINC24869333

Substance Information

In ZINC since Heavy atoms Benign functionality
January 22nd, 2009 13 No

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) -0.47 -0.76 -11.74 1 4 0 44 206.673 3
Lo Low (pH 4.5-6) -0.47 1.61 -44.98 2 4 1 45 207.681 3

Activity (Go SEA)

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