In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 21 | No |
Popular Name: N-[(2-morpholino-3-pyridyl)methyl]-1,4-dithiepan-6-amine N-[(2-morpholino-3-pyridyl)methy…
None
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) | 1.40 | 6.54 | -47.4 | 2 | 4 | 1 | 42 | 326.511 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.40 | 5.21 | -6.2 | 1 | 4 | 0 | 37 | 325.503 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 5.62 | -35.17 | 2 | 4 | 1 | 39 | 326.511 | 4 | ↓ |