UCSF

ZINC00000371

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 15 Yes

Popular Name: hydrastinine hydrochloride hydrastinine hydrochloride

Find On: PubMed — Wikipedia — Google

CAS Numbers: 4884-68-8 , 4884-68-8, 6592-85-4 [hyd , 4884-68-8, 6592-85-4 [hydrastinine]

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) 1.14 2.77 -31.2 1 4 0 46 207.229 0 ↓
Lo Low (pH 4.5-6) 1.14 2.34 -40.64 2 4 1 43 208.237 0 ↓
Lo Low (pH 4.5-6) 1.14 -0.51 -7.69 1 4 0 42 207.229 0 ↓

Vendor Notes

Note Type Comments Provided By
Therapy cardiotonic, uterine hemostatic SMDC MicroSource
PUBCHEM_PATENT_ID EP0108147A1; EP0737066A1; EP1021204A2; US4761417; US5153178; US5446070; US5656286; US5719197; US6024976; WO1983003970A1; WO1995018603A1; WO1996040086A2; WO1999015210A2; WO2000048636A1 IBM Patent Data

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