In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 18 | Yes |
Popular Name: (4S)-4-methyl-5-(2-piperazin-1-ylethyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine (4S)-4-methyl-5-(2-piperazin-1-y…
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) | 1.49 | 5.51 | -93.89 | 3 | 3 | 2 | 24 | 267.442 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.49 | 3.46 | -40.25 | 2 | 3 | 1 | 23 | 266.434 | 3 | ↓ |