UCSF

ZINC95676715

Substance Information

In ZINC since Heavy atoms Benign functionality
January 22nd, 2014 18 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) 3.54 4.26 -7.25 0 2 0 34 312.618 3

Vendor Notes

Note Type Comments Provided By
Melting_Point 59-63? Alfa-Aesar
Melting_Point 59-63° Alfa-Aesar

Activity (Go SEA)

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

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