In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2010 | 15 | Yes |
Popular Name: [3,5-dimethyl-1-[(2S)-2-methylpentyl]pyrazol-4-yl]methanamine [3,5-dimethyl-1-[(2S)-2-methylpe…
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 | 4.62 | -46.29 | 3 | 3 | 1 | 45 | 210.345 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.13 | 4.21 | -6.34 | 2 | 3 | 0 | 44 | 209.337 | 5 | ↓ |