UCSF

ZINC26687697

Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 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) 5.29 13.14 -18.06 0 6 0 60 472.614 6
Lo Low (pH 4.5-6) 5.29 14.06 -34.72 1 6 1 62 473.622 6

Activity (Go SEA)

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