In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 20 | Yes |
Popular Name: (2S)-N-(2-furylmethyl)-2-[[(3R)-quinuclidin-3-yl]amino]propanamide (2S)-N-(2-furylmethyl)-2-[[(3R)-…
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) | 0.84 | 5.17 | -108.05 | 4 | 5 | 2 | 63 | 279.384 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.84 | 1.59 | -7.35 | 2 | 5 | 0 | 58 | 277.368 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.84 | 4.01 | -41.03 | 3 | 5 | 1 | 59 | 278.376 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.84 | 2.75 | -39.67 | 3 | 5 | 1 | 62 | 278.376 | 5 | ↓ |