In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 18 | Yes |
Popular Name: (2S,4R,5R)-N-[(3R)-1-cyclopropylpyrrolidin-3-yl]-1,2,5-trimethyl-piperidin-4-amine (2S,4R,5R)-N-[(3R)-1-cyclopropyl…
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) | 1.84 | 7.77 | -76.79 | 3 | 3 | 2 | 21 | 253.434 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.84 | 6.35 | -109.48 | 3 | 3 | 2 | 24 | 253.434 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.84 | 5.39 | -32.8 | 2 | 3 | 1 | 20 | 252.426 | 3 | ↓ |