In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 16 | Yes |
Popular Name: 1-[(2S)-1-ethylpyrrolidin-2-yl]-N-[(3-methyl-2-thienyl)methyl]methanamine 1-[(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) | 2.57 | 7.33 | -30.79 | 2 | 2 | 1 | 16 | 239.408 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.57 | 4.99 | -1.86 | 1 | 2 | 0 | 15 | 238.4 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.57 | 6.26 | -37.17 | 2 | 2 | 1 | 20 | 239.408 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.57 | 8.6 | -113.54 | 3 | 2 | 2 | 21 | 240.416 | 5 | ↓ |