In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 21 | Yes |
Popular Name: 3-[3-[[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methyl]phenyl]prop-2-yn-1-ol 3-[3-[[(4S)-4-methyl-6,7-dihydro…
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) | 3.11 | 6.64 | -9.14 | 1 | 2 | 0 | 23 | 297.423 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.11 | 8.74 | -41.32 | 2 | 2 | 1 | 25 | 298.431 | 2 | ↓ |