In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2008 | 25 | No |
Popular Name: 5-[(3S)-dithiolan-3-yl]-N-[(6-morpholino-3-pyridyl)methyl]pentanamide 5-[(3S)-dithiolan-3-yl]-N-[(6-mo…
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) | 2.57 | 8.35 | -44.86 | 2 | 5 | 1 | 56 | 382.575 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.57 | 8.07 | -14.25 | 1 | 5 | 0 | 54 | 381.567 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.