UCSF

ZINC08214629

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 4th, 2006 43 No

Popular Name: Nonoxynol-9 Nonoxynol-9

Find On: PubMed — Wikipedia — Google

CAS Numbers: 14409-72-4 / '26571-11-9 , 26027-38-3 , 94349-40-3 , [14409-72-4]

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) 4.12 11.13 -18.22 1 10 0 103 616.833 35 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 2.14e-04 g/l DrugBank-approved
therap spermatocide, contraceptive MicroSource Spectrum

Activity (Go SEA)

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