UCSF

ZINC26363497

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2009 34 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 3.37 1.81 -26.54 3 10 0 143 503.606 10
Hi High (pH 8-9.5) 3.37 1.88 -49.65 2 10 -1 145 502.598 10

Activity (Go SEA)

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