In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 17 | Yes |
Popular Name: (3S)-1-isopropyl-N-(p-tolylmethyl)pyrrolidin-3-amine (3S)-1-isopropyl-N-(p-tolylmethy…
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) | 2.77 | 6.32 | -39.14 | 2 | 2 | 1 | 20 | 233.379 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 7.47 | -31.36 | 2 | 2 | 1 | 16 | 233.379 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 5.14 | -1.91 | 1 | 2 | 0 | 15 | 232.371 | 4 | ↓ |