UCSF

ZINC34959254

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 14 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) 0.20 -0.41 -10.51 1 5 0 59 242.728 5
Hi High (pH 8-9.5) 0.20 -0.71 -37.61 0 5 -1 61 241.72 5

Activity (Go SEA)

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