UCSF

ZINC37596457

Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2009 18 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) -0.41 5.76 -60.01 1 6 0 82 256.302 6
Hi High (pH 8-9.5) -0.41 3.41 -50.65 0 6 -1 81 255.294 6

Activity (Go SEA)

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