UCSF

ZINC35566783

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2009 37 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 5.88 16.36 -41.81 2 9 1 115 506.579 9
Hi High (pH 8-9.5) 5.88 13.78 -18.13 1 9 0 114 505.571 9

Vendor Notes

Note Type Comments Provided By
Purity 99% APIChem

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.