In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2009 | 24 | Yes |
Popular Name: 2-[(1S)-2-amino-1-(4-phenylpiperazin-1-yl)ethyl]-5-methoxy-phenol 2-[(1S)-2-amino-1-(4-phenylpiper…
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) | 2.29 | 1.89 | -49.02 | 4 | 5 | 1 | 64 | 328.436 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.29 | 2.68 | -51.29 | 3 | 5 | 0 | 66 | 327.428 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.29 | 3.75 | -129.4 | 5 | 5 | 2 | 65 | 329.444 | 5 | ↓ |