In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2010 | 25 | No |
Popular Name: N-[(2S)-2-(1-methylpyrrol-2-yl)-2-morpholino-ethyl]-N'-(2,2,2-trifluoroethyl)oxamide N-[(2S)-2-(1-methylpyrrol-2-yl)-…
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) | 0.13 | 0.52 | -8.18 | 2 | 7 | 0 | 76 | 362.352 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.13 | 2.63 | -40.1 | 3 | 7 | 1 | 77 | 363.36 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.