In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 19 | Yes |
Popular Name: (2S)-N-cyclopentyl-2-[[(3S)-quinuclidin-3-yl]amino]propanamide (2S)-N-cyclopentyl-2-[[(3S)-quin…
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) | 1.59 | 5.97 | -110.18 | 4 | 4 | 2 | 50 | 267.417 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.59 | 2.46 | -7.31 | 2 | 4 | 0 | 44 | 265.401 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.59 | 4.88 | -40.53 | 3 | 4 | 1 | 46 | 266.409 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.59 | 3.54 | -38.38 | 3 | 4 | 1 | 49 | 266.409 | 4 | ↓ |