In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 28th, 2008 | 26 | Yes |
Popular Name: (2R)-2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-morpholino-propan-1-one (2R)-2-[4-(1,3-benzodioxol-5-ylm…
None
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) | 1.05 | 4.7 | -40.88 | 1 | 7 | 1 | 56 | 362.45 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.05 | 4.79 | -47.77 | 1 | 7 | 1 | 56 | 362.45 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.05 | 2.55 | -11.58 | 0 | 7 | 0 | 54 | 361.442 | 4 | ↓ |