In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 17 | No |
Popular Name: (2R)-4-methyl-1-[[(2R)-oxiran-2-yl]methyl]-2-phenyl-piperazine (2R)-4-methyl-1-[[(2R)-oxiran-2-…
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) | 1.65 | 5.25 | -36.95 | 1 | 3 | 1 | 20 | 233.335 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.65 | 2.87 | -4.07 | 0 | 3 | 0 | 19 | 232.327 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.65 | 7.19 | -113.64 | 2 | 3 | 2 | 21 | 234.343 | 3 | ↓ |