In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 19 | Yes |
Popular Name: (2R)-5-[(2S)-4-methyl-2-phenyl-piperazin-1-yl]pentan-2-ol (2R)-5-[(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) | 2.09 | 5.82 | -35.42 | 2 | 3 | 1 | 28 | 263.405 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.09 | 3.43 | -3.52 | 1 | 3 | 0 | 27 | 262.397 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.09 | 7.75 | -111.62 | 3 | 3 | 2 | 29 | 264.413 | 5 | ↓ |