UCSF

ZINC62967166

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 19 Yes

Popular Name: (3S)-N,N-dimethyl-1-[5-(methylaminomethyl)imidazo[2,1-b]thiazol-6-yl]pyrrolidin-3-amine (3S)-N,N-dimethyl-1-[5-(methylam…

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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) 1.21 7.74 -96.52 3 5 2 42 281.429 4 ↓
Hi High (pH 8-9.5) 1.21 3.89 -9.68 1 5 0 36 279.413 4 ↓
Mid Mid (pH 6-8) 1.21 5.34 -47.89 2 5 1 40 280.421 4 ↓

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

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