UCSF

ZINC05127789

Substance Information

In ZINC since Heavy atoms Benign functionality
January 22nd, 2006 19 Yes

CAS Number: 58-63-9

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 -4.36 -29.95 4 9 0 133 268.229 2
Hi High (pH 8-9.5) -1.36 -5.48 -60.84 3 9 -1 137 267.221 2

Vendor Notes

Note Type Comments Provided By
MP 222-226 °C (dec.)(lit.) Indofine
Purity 97% APIChem
Therapy cell function activator SMDC Pharmakon
therap cell function activator, cardiotonic MicroSource World Drugs
SOLUBILITY H2O: 0.5 M, clear, colorless Indofine

Activity (Go SEA)

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