UCSF

ZINC37060009

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2009 18 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) 2.47 6.63 -6.9 1 5 0 71 263.684 4
Lo Low (pH 4.5-6) 2.47 7.09 -39.83 2 5 1 72 264.692 4

Activity (Go SEA)

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