In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: (2R)-2-[4-[(2S)-3-amino-2-methyl-propyl]piperazin-1-yl]-N-(2-methoxyethyl)propanamide (2R)-2-[4-[(2S)-3-amino-2-methyl…
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) | -0.79 | 0.71 | -88.05 | 5 | 6 | 2 | 74 | 288.436 | 8 | ↓ |
Mid Mid (pH 6-8) | -0.79 | 0.5 | -107.29 | 5 | 6 | 2 | 74 | 288.436 | 8 | ↓ |
Mid Mid (pH 6-8) | -0.79 | -1.41 | -48.79 | 4 | 6 | 1 | 72 | 287.428 | 8 | ↓ |