UCSF

ZINC67946779

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 25 Yes

Popular Name: (3S)-3-amino-3-(3,4-dimethoxyphenyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propanamide (3S)-3-amino-3-(3,4-dimethoxyphe…

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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) -0.98 6.21 -98.67 5 7 2 94 346.431 6 ↓
Hi High (pH 8-9.5) -0.98 5.4 -18.87 3 7 0 91 344.415 6 ↓
Mid Mid (pH 6-8) -0.98 5.75 -56.01 4 7 1 93 345.423 6 ↓

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Rings

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

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