UCSF

ZINC33825814

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 27 Yes

Popular Name: 1,3-Propanediamine, N'-(1-(3,4-dimethoxyphenyl)-2-phenylethyl)-N,N-diethyl-; BRN 2903949; LS-119837; N-Diethylaminopropyl-1-(3,4-dimethoxyphenyl)-2-phenylethylamine 1,3-Propanediamine, N'-(1-(3,4-d…

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Annotations

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) 4.18 10.98 -39.29 2 4 1 35 371.545 12 ↓
Lo Low (pH 4.5-6) 4.18 12.08 -123.59 3 4 2 40 372.553 12 ↓

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