UCSF

ZINC43439681

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 14th, 2010 19 No

Popular Name: 1-Octanamine, N-nitroso-N-octyl-; BRN 1785059; Dioctylamine, N-nitroso-; Dioctylnitrosamine; Dioctylnitrosoamine; Diocytlamine, N-nitroso-; LS-62102; N-Dioctylnitrosamine; N-Nitroso-N-octyl-1-octanamine; N-Nitroso-di-n-octylamine; NSC 38886; Nitrosodi-N-o 1-Octanamine, N-nitroso-N-octyl-…

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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) 7.06 11.37 -4.32 0 3 0 33 270.461 15 ↓
Lo Low (pH 4.5-6) 7.06 11.99 -12.45 1 3 0 34 271.469 15 ↓

Activity (Go SEA)

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