In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2009 | 18 | Yes |
Popular Name: (2S)-2-[4-(2-amino-2-oxo-ethyl)piperazin-1-yl]-N-cyclopropyl-propanamide (2S)-2-[4-(2-amino-2-oxo-ethyl)p…
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) | -1.23 | -0.35 | -38.09 | 4 | 6 | 1 | 80 | 255.342 | 5 | ↓ |
Hi High (pH 8-9.5) | -1.23 | -2.52 | -14.77 | 3 | 6 | 0 | 79 | 254.334 | 5 | ↓ |
Lo Low (pH 4.5-6) | -1.23 | 1.92 | -107.99 | 5 | 6 | 2 | 81 | 256.35 | 5 | ↓ |
Lo Low (pH 4.5-6) | -1.23 | -0.26 | -39.69 | 4 | 6 | 1 | 80 | 255.342 | 5 | ↓ |