In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 19 | Yes |
Popular Name: 2-[(3-dimethylamino-2,2-dimethyl-propyl)amino]-1-(4-methylpiperazin-1-yl)ethanone 2-[(3-dimethylamino-2,2-dimethyl…
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) | 0.18 | 6 | -84.67 | 3 | 5 | 2 | 41 | 272.437 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.18 | 3.72 | -38.7 | 2 | 5 | 1 | 40 | 271.429 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.18 | 7.29 | -169.14 | 4 | 5 | 3 | 46 | 273.445 | 6 | ↓ |