In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 19 | Yes |
Popular Name: (3S)-1-isopropyl-N-[4-(trifluoromethyl)cyclohexyl]pyrrolidin-3-amine (3S)-1-isopropyl-N-[4-(trifluoro…
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) | 3.15 | 6.11 | -40.1 | 2 | 2 | 1 | 20 | 279.37 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.15 | 8.59 | -113.65 | 3 | 2 | 2 | 21 | 280.378 | 4 | ↓ |