In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2011 | 21 | Yes |
Popular Name: N-[[(3S)-1-methylpyrrolidin-3-yl]methyl]-N-(2-quinolylmethyl)ethanamine N-[[(3S)-1-methylpyrrolidin-3-yl…
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) | 2.73 | 8.7 | -39.82 | 1 | 3 | 1 | 21 | 284.427 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 8.64 | -77.95 | 2 | 3 | 2 | 22 | 285.435 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.73 | 10.78 | -101.72 | 2 | 3 | 2 | 22 | 285.435 | 5 | ↓ |