UCSF

ZINC41473091

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: N-(3-pyridylmethyl)-1,3-dihydrothieno[3,4-b]quinolin-9-amine N-(3-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) 2.91 7.47 -29.93 2 3 1 39 294.403 3 ↓
Hi High (pH 8-9.5) 2.91 7.09 -9.24 1 3 0 38 293.395 3 ↓
Lo Low (pH 4.5-6) 2.91 7.94 -81.89 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.