UCSF

ZINC58233958

Substance Information

In ZINC since Heavy atoms Benign functionality
February 3rd, 2011 19 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) 1.12 6.05 -42.62 2 6 1 83 264.305 4
Hi High (pH 8-9.5) 1.12 4.61 -13.47 1 6 0 78 263.297 4

Activity (Go SEA)

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