UCSF

ZINC26895136

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2009 29 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) 3.62 9.77 -27.18 1 8 0 118 408.391 4
Hi High (pH 8-9.5) 3.62 10.55 -83.09 0 8 -1 121 407.383 4

Activity (Go SEA)

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