UCSF

ZINC00038943

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 18 Yes

CAS Number: 70794-01-3

Other Names:

MFCD00143520

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) 4.14 2.41 -9.97 0 2 0 30 236.27 1

Vendor Notes

Note Type Comments Provided By
MP 168-169.8o C Indofine
M.P. 169-170 C Indofine
SOLUBILITY Soluble in Chloroform Indofine
APPEARANCE White powder Indofine

Activity (Go SEA)

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