UCSF

ZINC00347230

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2005 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) 2.15 5.4 -35.69 2 2 1 25 192.282 2

Vendor Notes

Note Type Comments Provided By
Melting_Point 138-142? Alfa-Aesar
Melting_Point 138-142° Alfa-Aesar
MP 139 TCI

Activity (Go SEA)

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