In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 18 | Yes |
Popular Name: N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-1-prop-2-ynyl-piperidin-4-amine N-[[(2S)-1-ethylpyrrolidin-2-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) | 1.47 | 4.95 | -36.64 | 2 | 3 | 1 | 23 | 250.41 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 7.84 | -79.98 | 3 | 3 | 2 | 21 | 251.418 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 5.56 | -31.35 | 2 | 3 | 1 | 20 | 250.41 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 6.75 | -114.95 | 3 | 3 | 2 | 24 | 251.418 | 5 | ↓ |