UCSF

ZINC37841916

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 21 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) -1.60 -3.35 -17.39 4 9 0 134 317.371 4
Hi High (pH 8-9.5) -1.60 -3.72 -44.68 3 9 -1 136 316.363 4

Activity (Go SEA)

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