In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 17 | Yes |
Popular Name: (1S)-1-(benzothiophen-3-yl)-1-(2-furyl)-N-methyl-methanamine (1S)-1-(benzothiophen-3-yl)-1-(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) | 3.43 | 7.4 | -40.71 | 2 | 2 | 1 | 30 | 244.339 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.43 | 6.33 | -5.94 | 1 | 2 | 0 | 25 | 243.331 | 3 | ↓ |