In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2009 | 21 | Yes |
Popular Name: N-[(R)-(2,5-dichloro-3-thienyl)-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]ethanamine N-[(R)-(2,5-dichloro-3-thienyl)-…
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) | 4.39 | 8.07 | -40.74 | 2 | 3 | 1 | 35 | 345.271 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.39 | 7.51 | -4.31 | 1 | 3 | 0 | 30 | 344.263 | 4 | ↓ |