UCSF

ZINC00248419

Substance Information

In ZINC since Heavy atoms Benign functionality
October 15th, 2005 20 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) 1.26 5.76 -43.82 1 5 -1 86 298.384 6

Vendor Notes

Note Type Comments Provided By
Melting_Point 95-96? Alfa-Aesar
Melting_Point 95-96° Alfa-Aesar

Activity (Go SEA)

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