In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 18 | Yes |
Popular Name: (1S)-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-1-[(3R)-1-methyl-3-piperidyl]ethanamine (1S)-N-[[(2S)-1-ethylpyrrolidin-…
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) | 2.03 | 7.95 | -75.82 | 3 | 3 | 2 | 21 | 255.45 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.03 | 6.72 | -111.34 | 3 | 3 | 2 | 24 | 255.45 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.03 | 7.22 | -95.12 | 3 | 3 | 2 | 24 | 255.45 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.03 | 9.02 | -188.34 | 4 | 3 | 3 | 25 | 256.458 | 5 | ↓ |