In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 18 | Yes |
Popular Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-2-[(2S)-pyrrolidin-2-yl]acetamide N-[2-(4-methylpiperazin-1-yl)eth…
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) | 1.01 | 2.46 | -78.13 | 4 | 5 | 2 | 53 | 256.394 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.01 | 2.34 | -86.9 | 4 | 5 | 2 | 53 | 256.394 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.01 | 0.08 | -34.89 | 3 | 5 | 1 | 52 | 255.386 | 5 | ↓ |