In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 21 | Yes |
Popular Name: 3-pyrrolidin-1-yl-N-[(1S)-1-[3-(trifluoromethyl)phenyl]ethyl]propan-1-amine 3-pyrrolidin-1-yl-N-[(1S)-1-[3-(…
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) | 3.63 | 8.92 | -35.96 | 2 | 2 | 1 | 16 | 301.376 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.63 | 10.19 | -115 | 3 | 2 | 2 | 21 | 302.384 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.63 | 7.67 | -46.87 | 2 | 2 | 1 | 20 | 301.376 | 7 | ↓ |