In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 30 | Yes |
Popular Name: N-[(6S)-6-[4-(2-pyridyl)piperazin-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide N-[(6S)-6-[4-(2-pyridyl)piperazi…
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) | 3.56 | 9.99 | -42.5 | 2 | 6 | 1 | 63 | 420.562 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 9.67 | -16.12 | 1 | 6 | 0 | 61 | 419.554 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.56 | 12.37 | -112.66 | 3 | 6 | 2 | 64 | 421.57 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.56 | 12.05 | -56.07 | 2 | 6 | 1 | 63 | 420.562 | 4 | ↓ |