In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 31 | Yes |
Popular Name: 3-(1,3-benzothiazol-2-yl)-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]pyrazine-2-carboxamide 3-(1,3-benzothiazol-2-yl)-N-[(2S…
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) | 3.25 | 4.39 | -18.23 | 1 | 7 | 0 | 80 | 451.577 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.25 | 6.69 | -50.72 | 2 | 7 | 1 | 81 | 452.585 | 6 | ↓ |