UCSF

ZINC16693922

Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2008 23 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) 1.54 7.24 -26.45 1 8 0 121 312.285 3
Hi High (pH 8-9.5) 2.06 6.23 -33.72 0 8 -1 127 311.277 3

Activity (Go SEA)

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