UCSF

ZINC09272599

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2007 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) 3.37 9.88 -28.7 2 10 0 127 488.548 9
Ref Reference (pH 7) 3.37 9.76 -33.63 2 10 0 127 488.548 9
Ref Reference (pH 7) 3.37 10 -23.06 2 10 0 127 488.548 9

Activity (Go SEA)

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