UCSF

ZINC69875131

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2011 25 Yes

Popular Name: (2S)-N-[2-(4-methoxyphenyl)ethyl]-2-(1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)propanamide (2S)-N-[2-(4-methoxyphenyl)ethyl…

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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) 0.77 7.07 -36.72 2 6 1 61 343.451 6 ↓
Hi High (pH 8-9.5) 0.77 6.6 -20.47 1 6 0 59 342.443 6 ↓
Lo Low (pH 4.5-6) 0.77 8.67 -42.26 2 6 1 61 343.451 6 ↓

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

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