UCSF

ZINC56870924

Substance Information

In ZINC since Heavy atoms Benign functionality
January 10th, 2011 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) -3.93 -6.12 -203.66 3 11 -3 192 323.107 10
Mid Mid (pH 6-8) -3.93 -7.28 -101.84 4 11 -2 189 324.115 10

Vendor Notes

Note Type Comments Provided By
UniProt Database Links MNAA_BACSU; TAGA_BACSU; TAGA_STAAC; TAGA_STAAM; TAGA_STAAN; TAGA_STAAR; TAGA_STAAS; TAGA_STAAU; TAGA_STAAW; TAGB_BACSU; TAGC_BACSU; TAGD_BACSU; TAGE_BACSU; TAGF_BACSU; TAGO_BACSU ChEBI

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.