UCSF

ZINC60953906

Substance Information

In ZINC since Heavy atoms Benign functionality
April 3rd, 2011 21 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) 3.50 7.88 -12.78 2 5 0 67 298.427 9

Activity (Go SEA)

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