In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: 5-(4-tert-butylpiperazin-1-yl)-1,3-dimethyl-pyrazol-4-amine 5-(4-tert-butylpiperazin-1-yl)-1…
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) | 1.32 | 5.34 | -37.18 | 3 | 5 | 1 | 52 | 252.386 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.32 | 3.27 | -4.33 | 2 | 5 | 0 | 50 | 251.378 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.32 | 5.45 | -78.62 | 4 | 5 | 2 | 53 | 253.394 | 2 | ↓ |