UCSF

ZINC41473089

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 21 No

Popular Name: N-(2-pyridylmethyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine N-(2-pyridylmethyl)-1,3-dihydrot…

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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) 2.97 7.41 -27.78 2 3 1 39 294.403 3 ↓
Hi High (pH 8-9.5) 2.97 7.03 -9.46 1 3 0 38 293.395 3 ↓
Lo Low (pH 4.5-6) 2.97 7.82 -82.31 3 3 2 40 295.411 3 ↓

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

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