UCSF

ZINC09075877

Substance Information

In ZINC since Heavy atoms Benign functionality
August 7th, 2007 30 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) 6.05 12.52 -19.3 0 7 0 89 423.494 5
Ref Reference (pH 7) 6.05 11.22 -20.13 0 7 0 89 423.494 5

Activity (Go SEA)

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