In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 19 | Yes |
Popular Name: (2S)-1-amino-3-[4-(3-methoxyphenyl)piperazin-1-yl]propan-2-ol (2S)-1-amino-3-[4-(3-methoxyphen…
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) | 0.12 | -1.46 | -52.77 | 4 | 5 | 1 | 64 | 266.365 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.12 | -2.04 | -6.94 | 3 | 5 | 0 | 62 | 265.357 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.12 | 0.92 | -113.75 | 5 | 5 | 2 | 65 | 267.373 | 5 | ↓ |