In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 36 | No |
Popular Name: N-isobutyl-N-[[(3R,4R)-1-[(4-nitrophenyl)methyl]-4-(o-tolyl)pyrrolidin-3-yl]methyl]benzamide N-isobutyl-N-[[(3R,4R)-1-[(4-nit…
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) | 5.64 | 14.98 | -10.27 | 0 | 6 | 0 | 69 | 485.628 | 9 | ↓ |
Lo Low (pH 4.5-6) | 5.64 | 18.07 | -52.77 | 1 | 6 | 1 | 71 | 486.636 | 9 | ↓ |