UCSF

ZINC39347528

Substance Information

In ZINC since Heavy atoms Benign functionality
February 13th, 2010 9 Yes

Download: MOL2 SDF SMILES Flexibase

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) 0.68 0.99 -36.13 3 2 1 37 132.227 5

Vendor Notes

Note Type Comments Provided By
BP 85 / 1 TCI

Activity (Go SEA)

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