In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2011 | 21 | Yes |
Popular Name: 4-chloro-N-[2-[4-(2-dimethylaminoethyl)piperazin-1-yl]ethyl]aniline 4-chloro-N-[2-[4-(2-dimethylamin…
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) | 2.42 | 7.3 | -95.31 | 3 | 4 | 2 | 24 | 312.889 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.42 | 2.53 | -3.22 | 1 | 4 | 0 | 22 | 310.873 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.42 | 5.02 | -36.45 | 2 | 4 | 1 | 23 | 311.881 | 7 | ↓ |