UCSF

ZINC35586011

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2009 22 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) 4.88 10.13 -50.34 0 4 -1 62 296.346 7
Lo Low (pH 4.5-6) 4.88 10.48 -63.1 1 4 0 63 297.354 7

Activity (Go SEA)

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