In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 13 | Yes |
Popular Name: (3S)-N-ethyl-1-[(1S)-2-methoxy-1-methyl-ethyl]pyrrolidin-3-amine (3S)-N-ethyl-1-[(1S)-2-methoxy-1…
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) | 0.94 | 1.79 | -36.92 | 2 | 3 | 1 | 29 | 187.307 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.94 | 0.59 | -2.24 | 1 | 3 | 0 | 24 | 186.299 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.94 | 4.26 | -102.05 | 3 | 3 | 2 | 30 | 188.315 | 5 | ↓ |