In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2008 | 28 | Yes |
Popular Name: 2-(tert-butylamino)-N-[(2R)-2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]acetamide 2-(tert-butylamino)-N-[(2R)-2-(1…
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) | 4.29 | 8.16 | -39.74 | 4 | 5 | 1 | 71 | 380.512 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.29 | 6.91 | -10.48 | 3 | 5 | 0 | 66 | 379.504 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.97 | 5.72 | -36.72 | 4 | 5 | 1 | 74 | 380.512 | 8 | ↓ |