In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 16th, 2008 | 31 | Yes |
Popular Name: N-[(4-fluorophenyl)methyl]-2-morpholino-N-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]ethanamine N-[(4-fluorophenyl)methyl]-2-mor…
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) | 4.42 | 11.9 | -5.55 | 0 | 4 | 0 | 21 | 421.56 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.42 | 12.96 | -43.98 | 1 | 4 | 1 | 22 | 422.568 | 9 | ↓ |
Lo Low (pH 4.5-6) | 4.42 | 14.26 | -53.18 | 1 | 4 | 1 | 22 | 422.568 | 9 | ↓ |