In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2009 | 21 | No |
Popular Name: (1R)-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-1-(3-nitrophenyl)propan-1-amine (1R)-N-[[(2S)-1-ethylpyrrolidin-…
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) | 2.39 | 7.63 | -51.85 | 2 | 5 | 1 | 66 | 292.403 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.39 | 9.98 | -125.78 | 3 | 5 | 2 | 67 | 293.411 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.39 | 8.7 | -41.27 | 2 | 5 | 1 | 62 | 292.403 | 7 | ↓ |