In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2010 | 34 | Yes |
Popular Name: (5E,7E,10E)-(3S)-19-(3-carboxylpropyl)-9,10-seco-5,7,10(19)-cholestatrien-3-ol (5E,7E,10E)-(3S)-19-(3-carboxylp…
(5E,10E)-19-(3-carboxylpropyl)vitamin D3 / (5E,10E)-19-(3-carboxylpropyl)cholecalciferol
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) | 8.08 | 16.58 | -46.62 | 1 | 3 | -1 | 60 | 469.73 | 10 | ↓ |
Lo Low (pH 4.5-6) | 8.08 | 14.61 | -7.65 | 2 | 3 | 0 | 58 | 470.738 | 10 | ↓ |