In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 15 | Yes |
Popular Name: (2S)-3-ethyl-2-[(3S)-3-methyl-1-piperidyl]pentan-1-amine (2S)-3-ethyl-2-[(3S)-3-methyl-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) | 2.41 | 6.95 | -116.85 | 4 | 2 | 2 | 32 | 214.397 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 5.41 | -42.74 | 3 | 2 | 1 | 31 | 213.389 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 6.48 | -26.67 | 3 | 2 | 1 | 30 | 213.389 | 5 | ↓ |