UCSF

ZINC01575501

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 14 Yes

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) -3.44 -6.5 -69.5 5 7 0 125 203.198 5

Vendor Notes

Note Type Comments Provided By
MP 198 TCI
UniProt Database Links DPPA_BACSU; HMRR1_RHIME; LONM1_DICDI; TPSD3_ABIGR; TPSD6_ABIGR; TPSD8_ABIGR; TPSDA_ABIGR; TPSDB_ABIGR ChEBI

Activity (Go SEA)

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

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