In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 20 | Yes |
Popular Name: 1-[(2S)-1-ethylpyrrolidin-2-yl]-N-[(2-isopropoxyphenyl)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) | 3.04 | 7.71 | -32.13 | 2 | 3 | 1 | 29 | 277.432 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.04 | 8.11 | -29.53 | 2 | 3 | 1 | 26 | 277.432 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.04 | 9.52 | -108.58 | 3 | 3 | 2 | 30 | 278.44 | 7 | ↓ |