In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 22 | Yes |
Popular Name: (2S,4R)-1-indan-2-yl-4-(isopropylamino)-N-methyl-pyrrolidine-2-carboxamide (2S,4R)-1-indan-2-yl-4-(isopropy…
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) | 1.80 | 5.5 | -48.73 | 3 | 4 | 1 | 49 | 302.442 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.80 | 4.38 | -9.21 | 2 | 4 | 0 | 44 | 301.434 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.80 | 7.41 | -121.21 | 4 | 4 | 2 | 50 | 303.45 | 4 | ↓ |