UCSF

ZINC04259561

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2005 24 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) 2.41 3.18 -13.2 3 7 0 100 347.758 5
Hi High (pH 8-9.5) 2.41 4.08 -56.01 2 7 -1 103 346.75 5

Activity (Go SEA)

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