UCSF

ZINC49015568

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2010 25 Yes

CAS Number: 154361-50-9

Other Names:

XELODA

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) 1.88 0.22 -16.78 3 9 0 123 359.354 7

Vendor Notes

Note Type Comments Provided By
Therapy antineoplastic SMDC Pharmakon

Activity (Go SEA)

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