In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 18 | Yes |
Popular Name: (2S)-N-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-1-methoxy-propan-2-amine (2S)-N-[(5-chloro-2,3-dihydro-1,…
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) | 2.12 | 4.69 | -42.63 | 2 | 4 | 1 | 44 | 272.752 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.12 | 3.43 | -6.62 | 1 | 4 | 0 | 40 | 271.744 | 5 | ↓ |