In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2010 | 17 | Yes |
Popular Name: N-cyclopentyl-N-[2-(2-methylimidazol-1-yl)ethyl]ethane-1,2-diamine N-cyclopentyl-N-[2-(2-methylimid…
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) | 0.32 | 4.29 | -85.83 | 4 | 4 | 2 | 50 | 238.379 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.32 | 5.59 | -44.19 | 3 | 4 | 1 | 48 | 237.371 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.32 | 3.82 | -51.03 | 3 | 4 | 1 | 49 | 237.371 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.32 | 5.99 | -137.85 | 4 | 4 | 2 | 50 | 238.379 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.32 | 6.2 | -193.57 | 5 | 4 | 3 | 51 | 239.387 | 6 | ↓ |