UCSF

ZINC03978633

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2005 28 No

Popular Name: QUASSIN QUASSIN

Find On: PubMed — Wikipedia — Google

CAS Number: 76-78-8

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) 0.84 9.81 -21.35 0 6 0 79 388.46 2 ↓

Vendor Notes

Note Type Comments Provided By
Molecular_Solubility 3.858 Bitter DB
Therapy antiamebic SMDC MicroSource
therap insecticide, antiamoebic MicroSource Spectrum

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