In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2009 | 21 | Yes |
Popular Name: N-[(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methyl]ethanamine N-[(3-methyl-1-phenyl-5-pyrrolid…
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) | 2.37 | 9.79 | -102.03 | 3 | 4 | 2 | 39 | 286.423 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 8.59 | -7.26 | 1 | 4 | 0 | 33 | 284.407 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.37 | 9.97 | -40.19 | 2 | 4 | 1 | 38 | 285.415 | 5 | ↓ |