In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 20 | Yes |
Popular Name: 1-[4-[[(2R)-3-methyl-2-pyrrolidin-1-yl-butyl]amino]-1-piperidyl]ethanone 1-[4-[[(2R)-3-methyl-2-pyrrolidi…
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) | 1.42 | 7.66 | -128.2 | 3 | 4 | 2 | 41 | 283.46 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.42 | 5.14 | -46.32 | 2 | 4 | 1 | 40 | 282.452 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.42 | 7.38 | -36.97 | 2 | 4 | 1 | 37 | 282.452 | 5 | ↓ |