UCSF

ZINC40795303

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2010 19 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) 4.00 10.41 -25.73 2 2 1 26 277.457 4
Hi High (pH 8-9.5) 4.00 9.21 -3.91 1 2 0 24 276.449 4

Activity (Go SEA)

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