In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2008 | 29 | Yes |
Popular Name: 3-[(3S,4R)-1-isobutyl-4-morpholino-3-piperidyl]-N-(2-morpholinoethyl)propanamide 3-[(3S,4R)-1-isobutyl-4-morpholi…
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) | 1.35 | 4.36 | -46.24 | 2 | 7 | 1 | 58 | 411.611 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.35 | 6.71 | -96.13 | 3 | 7 | 2 | 60 | 412.619 | 9 | ↓ |