In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2009 | 17 | Yes |
Popular Name: N-butyl-4-(ethylaminomethyl)-N,2,5-trimethyl-pyrazol-3-amine N-butyl-4-(ethylaminomethyl)-N,2…
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) | 2.13 | 7.42 | -37.58 | 2 | 4 | 1 | 38 | 239.387 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.13 | 6.05 | -4.84 | 1 | 4 | 0 | 33 | 238.379 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.13 | 7.55 | -90.78 | 3 | 4 | 2 | 39 | 240.395 | 7 | ↓ |