UCSF

ZINC37665126

Substance Information

In ZINC since Heavy atoms Benign functionality
November 29th, 2009 19 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) 2.38 6.1 -13.74 0 5 0 66 276.214 6
Lo Low (pH 4.5-6) 2.38 8.21 -59.98 1 5 1 67 277.222 6

Activity (Go SEA)

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