In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 19 | Yes |
Popular Name: (2S)-3-ethyl-N1-[(3R)-1-isopropylpyrrolidin-3-yl]-N2,N2-dimethyl-pentane-1,2-diamine (2S)-3-ethyl-N1-[(3R)-1-isopropy…
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) | 3.06 | 7.87 | -86.57 | 3 | 3 | 2 | 21 | 271.493 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.06 | 6.57 | -30.02 | 2 | 3 | 1 | 20 | 270.485 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.06 | 5.23 | -32.87 | 2 | 3 | 1 | 20 | 270.485 | 8 | ↓ |