In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 21 | Yes |
Popular Name: (1S)-N-(1-ethylpropyl)-N-methyl-1-(1-phenylpyrazol-4-yl)ethane-1,2-diamine (1S)-N-(1-ethylpropyl)-N-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) | 2.13 | 5.88 | -49.65 | 3 | 4 | 1 | 49 | 287.431 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.13 | 8.26 | -131.91 | 4 | 4 | 2 | 50 | 288.439 | 7 | ↓ |