In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 21 | Yes |
Popular Name: (4R)-6-chloro-N-[(1S)-1-methyl-2-(1-piperidyl)ethyl]thiochroman-4-amine (4R)-6-chloro-N-[(1S)-1-methyl-2…
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) | 3.22 | 10.48 | -125.26 | 3 | 2 | 2 | 21 | 326.937 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.22 | 8.74 | -37.99 | 2 | 2 | 1 | 20 | 325.929 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 9.77 | -38.43 | 2 | 2 | 1 | 16 | 325.929 | 4 | ↓ |