In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2010 | 19 | Yes |
Popular Name: 2-[[(1S,2S)-2-cyanocycloheptyl]-cyclopentyl-amino]acetamide 2-[[(1S,2S)-2-cyanocycloheptyl]-…
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) | 2.54 | 5.05 | -41.86 | 3 | 4 | 1 | 71 | 264.393 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.54 | 3.38 | -9.79 | 2 | 4 | 0 | 70 | 263.385 | 4 | ↓ |