In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2008 | 21 | Yes |
Popular Name: N-(2,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide N-(2,5-dimethylphenyl)-3-(4-ethy…
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) | 2.51 | 7.1 | -39.64 | 2 | 4 | 1 | 37 | 290.431 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.51 | 4.83 | -8.34 | 1 | 4 | 0 | 36 | 289.423 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.51 | 7.09 | -42.14 | 2 | 4 | 1 | 37 | 290.431 | 5 | ↓ |