In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 17 | Yes |
Popular Name: (2S)-4-(4-isopropylpiperazin-1-yl)-N-propyl-butan-2-amine (2S)-4-(4-isopropylpiperazin-1-y…
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) | 2.17 | 6.26 | -81.78 | 3 | 3 | 2 | 24 | 243.439 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.17 | 4.05 | -35.6 | 2 | 3 | 1 | 23 | 242.431 | 7 | ↓ |