UCSF

ZINC11915267

Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2008 33 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) 3.19 1.57 -17 1 8 0 95 455.507 9
Mid Mid (pH 6-8) 2.60 1.4 -22.57 0 8 0 91 455.507 9

Activity (Go SEA)

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