UCSF

ZINC18101799

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2008 28 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) 3.74 9.17 -10.17 1 5 0 70 408.504 2
Ref Reference (pH 7) 3.74 9.01 -13.53 1 5 0 70 408.504 2

Activity (Go SEA)

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