In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 18 | Yes |
Popular Name: (1S)-N-ethyl-1-[4-(4-methylpiperazin-1-yl)phenyl]ethanamine (1S)-N-ethyl-1-[4-(4-methylpiper…
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 | 8.08 | -79.29 | 3 | 3 | 2 | 24 | 249.402 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.42 | 5.72 | -35.91 | 2 | 3 | 1 | 23 | 248.394 | 4 | ↓ |