In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 2nd, 2011 | 25 | No |
Popular Name: 1-benzyl-N-[(4-chloro-3-nitro-phenyl)methyl]piperidin-4-amine 1-benzyl-N-[(4-chloro-3-nitro-ph…
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) | 3.88 | 10.96 | -46.36 | 2 | 5 | 1 | 62 | 360.865 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.88 | 9.93 | -59.4 | 2 | 5 | 1 | 66 | 360.865 | 6 | ↓ |