UCSF

ZINC01708458

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 10 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) -3.21 -1.22 -34.89 3 5 0 94 147.13 4

Vendor Notes

Note Type Comments Provided By
MP 191-193°C Indofine
Purity 95+% Matrix Scientific
Purity 99% min APIChem
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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