UCSF

ZINC35017756

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 18 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) -2.08 -8.59 -36.56 7 8 1 142 258.254 3
Hi High (pH 8-9.5) -2.08 -8.71 -21.82 6 8 0 140 257.246 3

Activity (Go SEA)

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