In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 19 | Yes |
Popular Name: [3-[[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methyl]phenyl]methanamine [3-[[(4S)-4-methyl-6,7-dihydro-4…
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) | 2.73 | 5.88 | -44.52 | 3 | 2 | 1 | 31 | 273.425 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 7.96 | -99.67 | 4 | 2 | 2 | 32 | 274.433 | 3 | ↓ |