In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2010 | 15 | Yes |
Popular Name: (3S)-1-[(4-chloro-2-methyl-phenyl)methyl]pyrrolidin-3-amine (3S)-1-[(4-chloro-2-methyl-pheny…
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) | 1.79 | 3.94 | -45.27 | 3 | 2 | 1 | 31 | 225.743 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.79 | 6.08 | -121.65 | 4 | 2 | 2 | 32 | 226.751 | 2 | ↓ |