UCSF

ZINC10515589

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2007 23 Yes

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) 2.59 -3.24 -13.24 1 5 0 66 332.425 5
Hi High (pH 8-9.5) 2.59 -2.67 -43.5 0 5 -1 68 331.417 5

Activity (Go SEA)

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