UCSF

ZINC06754773

Substance Information

In ZINC since Heavy atoms Benign functionality
April 22nd, 2006 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) 2.09 6.42 -15.98 1 4 0 47 263.728 3
Mid Mid (pH 6-8) 2.80 5.73 -46.14 1 4 1 47 264.736 3

Activity (Go SEA)

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