In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 19 | Yes |
Popular Name: 2-[4-[[(2S)-2-cyanopropyl]-methyl-carbamoyl]piperazin-1-yl]acetic 2-[4-[[(2S)-2-cyanopropyl]-methy…
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) | -1.01 | 6.46 | -45.12 | 1 | 7 | 0 | 92 | 268.317 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.01 | 4.32 | -52.81 | 0 | 7 | -1 | 91 | 267.309 | 4 | ↓ |