In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 18 | Yes |
Popular Name: 3-[(1S)-1-methylbutyl]-4-(o-tolyl)-1H-pyrazol-5-amine 3-[(1S)-1-methylbutyl]-4-(o-toly…
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) | 4.23 | 7.33 | -4.92 | 3 | 3 | 0 | 55 | 243.354 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.23 | 7.45 | -27.95 | 4 | 3 | 1 | 56 | 244.362 | 4 | ↓ |