In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2008 | 34 | Yes |
Popular Name: (2S,4S)-1-benzyl-N-ethyl-4-[(9-ethylcarbazol-3-yl)methylamino]pyrrolidine-2-carboxamide (2S,4S)-1-benzyl-N-ethyl-4-[(9-e…
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) | 4.46 | 12.25 | -64.84 | 3 | 5 | 1 | 54 | 455.626 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.46 | 11.03 | -14.26 | 2 | 5 | 0 | 49 | 454.618 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.46 | 13.02 | -43.74 | 3 | 5 | 1 | 50 | 455.626 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.46 | 14.21 | -138.43 | 4 | 5 | 2 | 55 | 456.634 | 8 | ↓ |