UCSF

ZINC02539202

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 24 Yes

CAS Numbers: 30924-93-7 , 34404-30-3 , [30924-93-7]

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) 4.16 0.48 -50.84 1 7 -1 104 336.364 10

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
MP 97 TCI

Activity (Go SEA)

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