In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 19 | Yes |
Popular Name: (3S)-1-benzyl-N-[(1R)-1-cyclopropylethyl]piperidin-3-amine (3S)-1-benzyl-N-[(1R)-1-cyclopro…
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) | 3.12 | 10.01 | -111.82 | 3 | 2 | 2 | 21 | 260.425 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 7.8 | -36.51 | 2 | 2 | 1 | 20 | 259.417 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 9.05 | -33.22 | 2 | 2 | 1 | 16 | 259.417 | 5 | ↓ |