In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 19 | Yes |
Popular Name: 4-(ethylaminomethyl)-N,2,5-trimethyl-N-[(1R)-1,2,2-trimethylpropyl]pyrazol-3-amine 4-(ethylaminomethyl)-N,2,5-trime…
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) | 2.73 | 7.49 | -37.58 | 2 | 4 | 1 | 38 | 267.441 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.73 | 6.25 | -24.09 | 2 | 4 | 1 | 34 | 267.441 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.73 | 6.12 | -4.1 | 1 | 4 | 0 | 33 | 266.433 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 7.62 | -92.13 | 3 | 4 | 2 | 39 | 268.449 | 6 | ↓ |