UCSF

ZINC09631931

Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2007 28 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) 4.71 10.49 -21.03 2 8 0 116 417.878 7
Hi High (pH 8-9.5) 4.71 10.33 -43.91 1 8 -1 115 416.87 7

Activity (Go SEA)

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