UCSF

ZINC19218196

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2008 27 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) 0.70 5.2 -23.7 1 8 0 96 371.393 2
Hi High (pH 8-9.5) 0.89 3.42 -55.41 0 8 -1 102 370.385 2

Activity (Go SEA)

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