UCSF

ZINC14275599

Substance Information

In ZINC since Heavy atoms Benign functionality
July 6th, 2008 26 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) 5.60 11.68 -17.62 2 5 0 67 497.745 5
Lo Low (pH 4.5-6) 5.60 11.51 -35.12 3 5 1 68 498.753 5

Activity (Go SEA)

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