In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 17 | Yes |
Popular Name: 2-[4-[[(1S,2R)-1,2-dimethylbutyl]amino]-1-piperidyl]acetamide 2-[4-[[(1S,2R)-1,2-dimethylbutyl…
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) | 1.20 | 1.62 | -39.02 | 4 | 4 | 1 | 63 | 242.387 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.20 | 3.81 | -104.08 | 5 | 4 | 2 | 64 | 243.395 | 6 | ↓ |