In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 19 | No |
Popular Name: 1-[(2R)-1-ethylpyrrolidin-2-yl]-N-[(3-nitrophenyl)methyl]methanamine 1-[(2R)-1-ethylpyrrolidin-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) | 2.23 | 7.26 | -51.32 | 2 | 5 | 1 | 66 | 264.349 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 8.31 | -38.71 | 2 | 5 | 1 | 62 | 264.349 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 9.28 | -132.56 | 3 | 5 | 2 | 67 | 265.357 | 6 | ↓ |