In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2009 | 25 | Yes |
Popular Name: N-[(1S)-3-[[(2R)-2-dimethylamino-2-(2-thienyl)ethyl]amino]-1-methyl-3-oxo-propyl]benzamide N-[(1S)-3-[[(2R)-2-dimethylamino…
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) | 3.57 | 5.46 | -20.02 | 2 | 5 | 0 | 61 | 359.495 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.57 | 7.81 | -65.51 | 3 | 5 | 1 | 63 | 360.503 | 8 | ↓ |