In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 28 | No |
Popular Name: 4-(1,3-dithian-2-yl)-N-[(2S)-3-ethyl-2-morpholino-pentyl]benzamide 4-(1,3-dithian-2-yl)-N-[(2S)-3-e…
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) | 4.25 | 11.37 | -10.54 | 1 | 4 | 0 | 42 | 422.66 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.25 | 11.76 | -43.99 | 2 | 4 | 1 | 43 | 423.668 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.