UCSF

ZINC04583443

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2005 45 No

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) 9.41 19.88 -13.9 2 8 0 114 612.767 18
Hi High (pH 8-9.5) 9.41 20.88 -53.71 1 8 -1 116 611.759 18

Activity (Go SEA)

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