UCSF

ZINC20376730

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2008 9 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) -3.19 -2.38 -46.82 4 5 0 100 132.119 4
Mid Mid (pH 6-8) -3.19 -3.77 -54.73 3 5 -1 95 131.111 4

Activity (Go SEA)

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