In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 23 | Yes |
Popular Name: (2S)-N-cyclopropyl-2-[4-[2-oxo-2-(pentylamino)ethyl]piperazin-1-yl]propanamide (2S)-N-cyclopropyl-2-[4-[2-oxo-2…
None
None
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) | 1.59 | 2.11 | -14.06 | 2 | 6 | 0 | 65 | 324.469 | 9 | ↓ |
Lo Low (pH 4.5-6) | 1.59 | 4.35 | -36.31 | 3 | 6 | 1 | 66 | 325.477 | 9 | ↓ |
Lo Low (pH 4.5-6) | 1.59 | 4.29 | -42.19 | 3 | 6 | 1 | 66 | 325.477 | 9 | ↓ |