UCSF

ZINC39807434

Substance Information

In ZINC since Heavy atoms Benign functionality
March 8th, 2010 26 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) -4.76 1.12 -147.75 6 11 -1 200 371.37 10
Hi High (pH 8-9.5) -4.76 0.86 -136.73 5 11 -2 199 370.362 10

Activity (Go SEA)

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