In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 27 | Yes |
Popular Name: 1-[(2R)-1-ethylpyrrolidin-2-yl]-N-(3-pyridylmethyl)-N-(6-quinolylmethyl)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) | 2.68 | 11.34 | -42.81 | 1 | 4 | 1 | 33 | 361.513 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.68 | 9.37 | -6.87 | 0 | 4 | 0 | 32 | 360.505 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.68 | 10.6 | -37.05 | 1 | 4 | 1 | 33 | 361.513 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.68 | 11.06 | -95.83 | 2 | 4 | 2 | 35 | 362.521 | 7 | ↓ |