In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 22nd, 2009 | 19 | Yes |
Popular Name: N-[(2R)-2-(diethylamino)propyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide N-[(2R)-2-(diethylamino)propyl]-…
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) | 0.87 | 2.51 | -42.32 | 3 | 6 | 1 | 79 | 289.425 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.87 | 0.41 | -9.91 | 2 | 6 | 0 | 78 | 288.417 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.87 | 2.73 | -29.59 | 2 | 6 | 0 | 81 | 288.417 | 7 | ↓ |