In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2008 | 20 | Yes |
Popular Name: N-[(4-tert-butylphenyl)methyl]-1-[(2R)-1-ethylpyrrolidin-2-yl]methanamine N-[(4-tert-butylphenyl)methyl]-1…
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) | 4.00 | 8.92 | -37.43 | 2 | 2 | 1 | 20 | 275.46 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.00 | 9.97 | -28.77 | 2 | 2 | 1 | 16 | 275.46 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.00 | 11.09 | -117.21 | 3 | 2 | 2 | 21 | 276.468 | 6 | ↓ |