UCSF

ZINC06345071

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2006 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) 2.52 2.66 -8.95 3 5 0 77 253.261 2
Ref Reference (pH 7) 2.34 2.51 -30.49 4 5 1 75 254.269 3

Activity (Go SEA)

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