In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 1st, 2006 | 30 | Yes |
Popular Name: 3-[2-(3,4-diethoxyphenyl)ethylaminomethyl]-6-methoxy-1H-indole-2-carboxylic 3-[2-(3,4-diethoxyphenyl)ethylam…
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) | 3.69 | 9.74 | -50.8 | 3 | 7 | 0 | 100 | 412.486 | 11 | ↓ |
Hi High (pH 8-9.5) | 3.69 | 8.38 | -52.31 | 2 | 7 | -1 | 96 | 411.478 | 11 | ↓ |