UCSF

ZINC12495043

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) 5.22 13.2 -242.32 0 7 -3 122 447.425 14
Mid Mid (pH 6-8) 5.22 12.05 -122.23 1 7 -2 119 448.433 14

Vendor Notes

Note Type Comments Provided By
UniProt Database Links ACS_PLEBE; CARS_ARTAN; CASS_RICCO; CAS_ABIBA; CHLP_ARATH; CHLP_ORYSJ; CHLP_SYNY3; CHLP_TOBAC; CLDS_CISCR; CLDS_TOBAC; CPS1_ORYSJ; CPS2_ORYSI; CPS2_ORYSJ; CPS4_ORYSI; CPS4_ORYSJ; CPSKS_GIBFU; CPSKS_PHASA; CRIT_STRCO; CRTB_ENTAG; CRTB_ESCVU; CRTB_MYCBO; CRT ChEBI

Activity (Go SEA)

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