UCSF

ZINC12811987

Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2008 24 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) 2.43 7.47 -10.84 1 5 0 66 348.83 5
Ref Reference (pH 7) 2.43 7.55 -12.11 1 5 0 66 348.83 5
Ref Reference (pH 7) 2.43 7.48 -10.77 1 5 0 66 348.83 5

Activity (Go SEA)

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