UCSF

ZINC27019832

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2009 34 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) 5.43 13.48 -18.17 0 6 0 60 472.614 6
Lo Low (pH 4.5-6) 5.43 14.39 -36.07 1 6 1 62 473.622 6

Activity (Go SEA)

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