UCSF

ZINC03632377

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 21 No

Popular Name: LS-103791; Phenetole, beta-(N-(2-chloroethyl)-N-ethylamino)-2-isopropyl-4-methoxy-5-methyl-, hydrochloride; WV 0035; beta-(N-(2-Chloroethyl)-N-ethylamino)-2-isopropyl-4-methoxy-5-methylphenetole hydrochloride; p-Cymene, 5-(2-(N-(2-chloroethyl)-N-ethylamin LS-103791; Phenetole, beta-(N-(2…

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Vendors

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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) 4.41 10.18 -39.85 1 3 1 23 314.877 9 ↓
Mid Mid (pH 6-8) 4.41 7.91 -4.1 0 3 0 22 313.869 9 ↓

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