In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2010 | 13 | Yes |
Popular Name: (3S)-3-[(3S,5S)-3,5-dimethyl-1-piperidyl]butan-1-amine (3S)-3-[(3S,5S)-3,5-dimethyl-1-p…
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) | 1.37 | 4.99 | -105 | 4 | 2 | 2 | 32 | 186.343 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.37 | 4.6 | -29.02 | 3 | 2 | 1 | 30 | 185.335 | 3 | ↓ |