In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2010 | 18 | Yes |
Popular Name: (1S)-1-(benzothiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine (1S)-1-(benzothiophen-2-yl)-N-me…
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) | 2.64 | 6.93 | -30.69 | 2 | 3 | 1 | 31 | 258.37 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.64 | 6.32 | -10.59 | 1 | 3 | 0 | 30 | 257.362 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.64 | 7.46 | -39.12 | 2 | 3 | 1 | 34 | 258.37 | 3 | ↓ |