In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 17 | Yes |
Popular Name: 2-[4-[(2S)-2-aminopropanoyl]piperazin-1-yl]-N,N-dimethyl-acetamide 2-[4-[(2S)-2-aminopropanoyl]pipe…
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) | -2.33 | -0.45 | -50.79 | 3 | 6 | 1 | 71 | 243.331 | 3 | ↓ |
Hi High (pH 8-9.5) | -2.33 | -0.78 | -14.98 | 2 | 6 | 0 | 70 | 242.323 | 3 | ↓ |
Mid Mid (pH 6-8) | -2.33 | 1.71 | -104.89 | 4 | 6 | 2 | 73 | 244.339 | 3 | ↓ |