In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2010 | 18 | Yes |
Popular Name: (2S)-4-[(2S)-4-methyl-2-phenyl-piperazin-1-yl]butan-2-ol (2S)-4-[(2S)-4-methyl-2-phenyl-p…
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) | 1.45 | 5.03 | -35.29 | 2 | 3 | 1 | 28 | 249.378 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.45 | 2.64 | -3.74 | 1 | 3 | 0 | 27 | 248.37 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.45 | 6.95 | -110.62 | 3 | 3 | 2 | 29 | 250.386 | 4 | ↓ |