UCSF

ZINC18158999

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 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) 3.12 8.91 -26.26 2 10 0 127 474.521 8
Ref Reference (pH 7) 3.12 8.8 -33.77 2 10 0 127 474.521 8

Activity (Go SEA)

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