| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2008 | 29 | No |
Popular Name: N'-(2-cyanophenyl)-N-[(2S)-2-dimethylamino-2-(1-methylindol-3-yl)ethyl]oxamide N'-(2-cyanophenyl)-N-[(2S)-2-dim…
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| 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) | 1.76 | 9.24 | -47.19 | 3 | 7 | 1 | 91 | 390.467 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.94 | 5.54 | -47.4 | 1 | 7 | -1 | 96 | 388.451 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.76 | 6.92 | -11.67 | 2 | 7 | 0 | 90 | 389.459 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 8.48 | -53.05 | 2 | 7 | 0 | 98 | 389.459 | 6 | ↓ |
