In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 21 | Yes |
Popular Name: (2S,4S,5R)-N-[(1R)-2,2-dimethyl-1-phenyl-propyl]-1,2,5-trimethyl-piperidin-4-amine (2S,4S,5R)-N-[(1R)-2,2-dimethyl-…
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) | 4.61 | 11.06 | -102.5 | 3 | 2 | 2 | 21 | 290.495 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.61 | 8.75 | -30.17 | 2 | 2 | 1 | 20 | 289.487 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.61 | 10.49 | -32.49 | 2 | 2 | 1 | 16 | 289.487 | 4 | ↓ |