UCSF

ZINC07256039

Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2006 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) 2.02 6.83 -24.14 1 6 0 77 330.413 4
Lo Low (pH 4.5-6) 2.02 7.09 -42.24 2 6 1 78 331.421 4

Activity (Go SEA)

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