UCSF

ZINC03561993

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2004 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) 2.67 6.54 -9.52 1 6 0 88 297.723 3
Hi High (pH 8-9.5) 2.74 5.67 -39.4 0 6 -1 94 296.715 3

Activity (Go SEA)

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