In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2008 | 27 | Yes |
Popular Name: (2S)-N-(1,3-benzodioxol-5-yl)-2-[1-(o-tolyl)imidazol-2-yl]sulfanyl-propanamide (2S)-N-(1,3-benzodioxol-5-yl)-2-…
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) | 3.86 | 9.56 | -16.65 | 1 | 6 | 0 | 65 | 381.457 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.86 | 9.9 | -46.83 | 2 | 6 | 1 | 67 | 382.465 | 5 | ↓ |