In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: 2-[[(1S,2S)-2-aminocycloheptyl]-cyclopentyl-amino]acetamide 2-[[(1S,2S)-2-aminocycloheptyl]-…
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) | 1.24 | 2.77 | -123.09 | 6 | 4 | 2 | 75 | 255.406 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.24 | 1.52 | -48.92 | 5 | 4 | 1 | 74 | 254.398 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.24 | 2.93 | -30.45 | 5 | 4 | 1 | 74 | 254.398 | 4 | ↓ |