UCSF

ZINC27527823

Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2009 36 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) 5.73 11.02 -56.3 0 7 -1 93 483.544 8
Lo Low (pH 4.5-6) 5.28 12.79 -16.44 1 7 0 90 484.552 8

Activity (Go SEA)

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