In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 21 | Yes |
Popular Name: (3S)-N-[(3R)-1-benzylpyrrolidin-3-yl]-1-isopropyl-pyrrolidin-3-amine (3S)-N-[(3R)-1-benzylpyrrolidin-…
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) | 2.47 | 9.13 | -85.09 | 3 | 3 | 2 | 21 | 289.467 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.47 | 6.66 | -36.21 | 2 | 3 | 1 | 20 | 288.459 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.47 | 7.82 | -111.61 | 3 | 3 | 2 | 24 | 289.467 | 5 | ↓ |