In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 20 | Yes |
Popular Name: 1-[(3R,5R)-4-[3-(dimethylamino)propyl]-3,5-dimethyl-piperazin-1-yl]-3-methyl-butan-1-one 1-[(3R,5R)-4-[3-(dimethylamino)p…
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) | 2.17 | 7.45 | -43.04 | 1 | 4 | 1 | 28 | 284.468 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.17 | 9.45 | -109.2 | 2 | 4 | 2 | 29 | 285.476 | 6 | ↓ |