In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: [2-[2-(4-propylpiperazin-1-yl)ethoxy]phenyl]methanamine [2-[2-(4-propylpiperazin-1-yl)et…
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) | 1.93 | 5.11 | -89.43 | 4 | 4 | 2 | 45 | 279.428 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.93 | 2.85 | -39.69 | 3 | 4 | 1 | 43 | 278.42 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.93 | 5.12 | -102.6 | 4 | 4 | 2 | 45 | 279.428 | 7 | ↓ |