UCSF

ZINC36204477

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 26 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.70 5.25 -13.96 2 6 0 82 375.494 8
Mid Mid (pH 6-8) 2.70 7.89 -49.66 3 6 1 84 376.502 8

Activity (Go SEA)

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