In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 19 | Yes |
Popular Name: 5-chloro-2-[3-(4-methylpiperazin-1-yl)propoxy]aniline 5-chloro-2-[3-(4-methylpiperazin…
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) | 2.28 | 4.9 | -37.62 | 3 | 4 | 1 | 43 | 284.811 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.28 | 2.43 | -4.64 | 2 | 4 | 0 | 42 | 283.803 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.28 | 4.76 | -40.57 | 3 | 4 | 1 | 43 | 284.811 | 5 | ↓ |