UCSF

ZINC18162387

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2008 29 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) 3.02 6.2 -14.82 1 8 0 94 411.849 5
Ref Reference (pH 7) 3.02 5.86 -13.23 1 8 0 94 411.849 5
Ref Reference (pH 7) 3.02 5.85 -15.21 1 8 0 94 411.849 5

Activity (Go SEA)

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