UCSF

ZINC07166015

Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2006 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) 2.51 7.44 -15.79 1 4 0 51 343.429 3
Hi High (pH 8-9.5) 2.51 8.37 -52.73 0 4 -1 54 342.421 3

Activity (Go SEA)

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