UCSF

ZINC69819113

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2011 23 Yes

Popular Name: 1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-[(2S)-2-(dimethylaminomethyl)morpholin-4-yl]propan-1- 1-(6,7-dihydro-4H-thieno[3,2-c]p…

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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) 1.09 6.4 -39.21 1 5 1 37 338.497 5 ↓
Hi High (pH 8-9.5) 1.09 3.86 -9.3 0 5 0 36 337.489 5 ↓
Lo Low (pH 4.5-6) 1.09 8.68 -105.58 2 5 2 38 339.505 5 ↓

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Rings

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

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