In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 18 | Yes |
Popular Name: (2S)-3-methyl-N-(2-pyridylmethyl)-2-pyrrolidin-1-yl-butan-1-amine (2S)-3-methyl-N-(2-pyridylmethyl…
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) | 1.87 | 7.38 | -111.44 | 3 | 3 | 2 | 34 | 249.402 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.87 | 6.82 | -30.09 | 2 | 3 | 1 | 29 | 248.394 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.87 | 7.19 | -88.11 | 3 | 3 | 2 | 31 | 249.402 | 6 | ↓ |