UCSF

ZINC06563918

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2006 27 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) 4.05 6.67 -16.74 2 7 0 93 367.405 5
Hi High (pH 8-9.5) 4.05 7.51 -65.1 1 7 -1 96 366.397 5

Activity (Go SEA)

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