In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 18 | Yes |
Popular Name: N3-[(1-ethyl-4-piperidyl)methyl]-2,5-dimethyl-pyrazole-3,4-diamine N3-[(1-ethyl-4-piperidyl)methyl]…
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) | 1.18 | 4.89 | -41.3 | 4 | 5 | 1 | 60 | 252.386 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.18 | 5.01 | -75.26 | 5 | 5 | 2 | 62 | 253.394 | 4 | ↓ |