UCSF

ZINC05520147

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2006 24 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) 1.54 8.16 -16.88 1 5 0 64 355.444 4
Lo Low (pH 4.5-6) 1.54 8.44 -59.53 2 5 1 65 356.452 4

Activity (Go SEA)

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