In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 17 | Yes |
Popular Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-2-(propylamino)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) | 0.16 | 2.29 | -84.64 | 4 | 5 | 2 | 53 | 244.383 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.16 | -1.44 | -7.97 | 2 | 5 | 0 | 48 | 242.367 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.16 | 2.17 | -94.79 | 4 | 5 | 2 | 53 | 244.383 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.16 | -0.09 | -41.84 | 3 | 5 | 1 | 52 | 243.375 | 7 | ↓ |