UCSF

ZINC20357867

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2008 35 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) 4.33 13.96 -78.9 1 6 0 74 470.569 10
Lo Low (pH 4.5-6) 4.33 13.14 -55.08 2 6 1 71 471.577 10

Activity (Go SEA)

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