In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2010 | 22 | Yes |
Popular Name: 2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-N-[(3S)-2-oxoazepan-3-yl]acetamide 2-[[(1S)-1-(2-chlorophenyl)ethyl…
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) | 2.29 | 3.29 | -12.46 | 3 | 5 | 0 | 70 | 323.824 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.29 | 4.42 | -43.08 | 4 | 5 | 1 | 75 | 324.832 | 5 | ↓ |