UCSF

ZINC18120327

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2008 36 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) 4.01 11.35 -18.65 0 10 0 114 489.484 6
Ref Reference (pH 7) 4.01 12.1 -10.49 0 10 0 114 489.484 6

Activity (Go SEA)

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