In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 17 | Yes |
Popular Name: [4-[(2S)-3-amino-2-methyl-propyl]piperazin-1-yl]-[(1R,2S)-2-methylcyclopropyl]methanone [4-[(2S)-3-amino-2-methyl-propyl…
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) | 0.59 | 3.46 | -50.28 | 3 | 4 | 1 | 51 | 240.371 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.59 | 5.26 | -115.67 | 4 | 4 | 2 | 52 | 241.379 | 4 | ↓ |