UCSF

ZINC33757218

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2009 34 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) 2.07 6.61 -34.92 4 13 1 160 470.514 8
Hi High (pH 8-9.5) 2.07 4.34 -14.27 3 13 0 159 469.506 8

Activity (Go SEA)

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