UCSF

ZINC27888889

Substance Information

In ZINC since Heavy atoms Benign functionality
February 21st, 2009 21 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) 1.19 3.59 -54.19 4 6 1 87 289.359 6
Hi High (pH 8-9.5) 1.19 2.2 -14.4 3 6 0 83 288.351 6

Activity (Go SEA)

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