UCSF

ZINC66322933

Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2011 15 Yes

CAS Number: 299-28-5

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) -3.64 -9.31 -50.46 6 8 -1 161 225.173 6

Vendor Notes

Note Type Comments Provided By
therap calcium replenisher MicroSource Spectrum

Activity (Go SEA)

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

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