In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 20 | Yes |
Popular Name: 3-(dimethylamino)-N-[5-(4-methylpiperazin-1-yl)pentyl]propanamide 3-(dimethylamino)-N-[5-(4-methyl…
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) | 0.69 | 5.52 | -83.61 | 3 | 5 | 2 | 41 | 286.464 | 9 | ↓ |
Hi High (pH 8-9.5) | 0.69 | 3.26 | -40.61 | 2 | 5 | 1 | 40 | 285.456 | 9 | ↓ |
Mid Mid (pH 6-8) | 0.69 | 5.64 | -79.91 | 3 | 5 | 2 | 41 | 286.464 | 9 | ↓ |