UCSF

ZINC00153224

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 9 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) 1.58 3.77 -6.18 0 2 0 30 124.139 1

Vendor Notes

Note Type Comments Provided By
BP 100 / 12 TCI
BP [°C] 98 - 100 (p=12 torr) Acros Organics
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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