UCSF

ZINC06093451

Substance Information

In ZINC since Heavy atoms Benign functionality
March 5th, 2006 12 No

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) 1.31 4.56 -22.44 1 3 1 20 162.216 2
Hi High (pH 8-9.5) 1.31 4.07 -11.09 0 3 0 19 161.208 2

Activity (Go SEA)

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