In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 28th, 2010 | 25 | Yes |
Popular Name: (2S,4R)-4-(benzylamino)-1-[(2-chlorophenyl)methyl]-N-methyl-pyrrolidine-2-carboxamide (2S,4R)-4-(benzylamino)-1-[(2-ch…
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) | 2.77 | 8.09 | -38.4 | 3 | 4 | 1 | 46 | 358.893 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.77 | 9.31 | -128.95 | 4 | 4 | 2 | 50 | 359.901 | 6 | ↓ |