In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 21 | Yes |
Popular Name: N,N-dimethyl-N'-[(3S)-1-phenethylpyrrolidin-3-yl]butane-1,4-diamine N,N-dimethyl-N'-[(3S)-1-phenethy…
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) | 2.62 | 8.69 | -95.86 | 3 | 3 | 2 | 24 | 291.483 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.62 | 7.5 | -34.4 | 2 | 3 | 1 | 20 | 290.475 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.62 | 9.98 | -81.44 | 3 | 3 | 2 | 21 | 291.483 | 9 | ↓ |