UCSF

ZINC35685980

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2009 23 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) 1.75 5.32 -56.42 1 9 -1 141 345.353 10
Lo Low (pH 4.5-6) 1.75 3.36 -18.83 2 9 0 139 346.361 10

Activity (Go SEA)

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