In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2010 | 12 | Yes |
Popular Name: (3S)-1-[(1S)-2-ethoxy-1-methyl-ethyl]pyrrolidin-3-amine (3S)-1-[(1S)-2-ethoxy-1-methyl-e…
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) | 0.03 | 2.34 | -27.67 | 3 | 3 | 1 | 40 | 173.28 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.03 | 0.1 | -43.48 | 3 | 3 | 1 | 40 | 173.28 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.03 | 2.63 | -107.51 | 4 | 3 | 2 | 41 | 174.288 | 4 | ↓ |