UCSF

ZINC03831558

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2005 22 No

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) 0.16 -9.99 -13.74 2 9 0 115 339.366 3

Vendor Notes

Note Type Comments Provided By
Molecular_Solubility 0.855 Bitter DB

Activity (Go SEA)

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