UCSF

ZINC37215381

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 17 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) 2.36 7.07 -37.31 2 2 1 26 250.387 3
Hi High (pH 8-9.5) 2.36 5.85 -2.97 1 2 0 21 249.379 3

Activity (Go SEA)

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