UCSF

ZINC36160749

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 17 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) -1.63 -1.34 -61.22 3 6 1 83 259.355 3
Hi High (pH 8-9.5) -1.63 -2.08 -14.59 2 6 0 81 258.347 3

Activity (Go SEA)

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