UCSF

ZINC62969915

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 18 Yes

Popular Name: (3S)-1-[[(3S)-3-(ethylaminomethyl)tetrahydrofuran-3-yl]methyl]-N,N-dimethyl-pyrrolidin-3-amine (3S)-1-[[(3S)-3-(ethylaminomethy…

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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) 0.49 4.42 -85.88 3 4 2 34 257.422 6 ↓
Hi High (pH 8-9.5) 0.49 2.03 -38.48 2 4 1 32 256.414 6 ↓
Lo Low (pH 4.5-6) 0.49 6.33 -196.45 4 4 3 35 258.43 6 ↓

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

No pre-computed analogs available. Try a structural similarity search.