In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 18 | Yes |
Popular Name: N-ethyl-2-[[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]sulfonyl]ethanamine N-ethyl-2-[[(4S)-4-methyl-6,7-di…
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) | 1.35 | 4.15 | -48.06 | 2 | 4 | 1 | 54 | 289.446 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.35 | 2.79 | -8.67 | 1 | 4 | 0 | 49 | 288.438 | 5 | ↓ |