In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 20 | Yes |
Popular Name: 3-[5-[[2-methoxyethyl-[(1S)-2-methoxy-1-methyl-ethyl]amino]methyl]-3-thienyl]prop-2-yn-1-ol 3-[5-[[2-methoxyethyl-[(1S)-2-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) | 1.44 | 3.99 | -36.95 | 2 | 4 | 1 | 43 | 298.428 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.44 | 2.55 | -8.7 | 1 | 4 | 0 | 42 | 297.42 | 8 | ↓ |