In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 26 | Yes |
Popular Name: (2R)-1-(4-ethylpiperazin-1-yl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-one (2R)-1-(4-ethylpiperazin-1-yl)-2…
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) | 1.91 | 6.95 | -40.43 | 1 | 6 | 1 | 40 | 361.51 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 9.16 | -98.2 | 2 | 6 | 2 | 42 | 362.518 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 6.74 | -45.52 | 1 | 6 | 1 | 40 | 361.51 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 4.53 | -8.95 | 0 | 6 | 0 | 39 | 360.502 | 5 | ↓ |