In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 13 | Yes |
Popular Name: 2-{4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}propan-1-amine 2-{4H,5H,6H,7H-thieno[3,2-c]pyri…
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CAS Numbers: 1170184-80-1 , 954270-24-7
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) | 0.74 | 2.83 | -42.28 | 3 | 2 | 1 | 31 | 197.327 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.74 | 4.55 | -122.18 | 4 | 2 | 2 | 32 | 198.335 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |