UCSF

ZINC43919186

Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2010 22 No

CAS Number: [19408-84-5]

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) 1.82 8.83 -14.95 1 4 0 55 307.434 9

Vendor Notes

Note Type Comments Provided By
MP 62-65 °C(lit.) Indofine
SOLUBILITY H2O: insoluble Indofine

Activity (Go SEA)

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