In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 16th, 2010 | 24 | Yes |
Popular Name: 3-[3-[[[(2R)-1-ethylpyrrolidin-2-yl]methylamino]methyl]indol-1-yl]propanamide 3-[3-[[[(2R)-1-ethylpyrrolidin-2…
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) | 1.51 | 6.79 | -34.54 | 4 | 5 | 1 | 64 | 329.468 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.51 | 6.27 | -44.02 | 4 | 5 | 1 | 68 | 329.468 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.51 | 8.07 | -122.72 | 5 | 5 | 2 | 69 | 330.476 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.