In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2010 | 16 | Yes |
Popular Name: (3S)-1-[(3-chloro-2-methyl-phenyl)methyl]piperidin-3-amine (3S)-1-[(3-chloro-2-methyl-pheny…
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) | 2.04 | 4.92 | -45.25 | 3 | 2 | 1 | 31 | 239.77 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.04 | 6.6 | -119.49 | 4 | 2 | 2 | 32 | 240.778 | 2 | ↓ |