UCSF

ZINC33829319

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 16 Yes

Popular Name: 3-Pyrrolidineamine, 1-benzyl-N-ethyl-N-methyl-, dihydrochloride, (S)-; L-(S)-N-Benzyl-3-ethylmethylaminopyrrolidine dihydrochloride; LS-137198; Pyrrolidine, 1-benzyl-3-(ethylmethylamino)-, dihydrochloride, L-(S)- 3-Pyrrolidineamine, 1-benzyl-N-e…

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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) 2.27 7.04 -33.93 1 2 1 8 219.352 4 ↓
Mid Mid (pH 6-8) 2.27 6.86 -33.97 1 2 1 8 219.352 4 ↓
Lo Low (pH 4.5-6) 2.27 9.3 -106.28 2 2 2 9 220.36 4 ↓

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