In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: (3S)-3-(aminomethyl)-1-benzyl-N-cyclopropyl-N-ethyl-pyrrolidin-3-amine (3S)-3-(aminomethyl)-1-benzyl-N-…
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) | 1.51 | 6.42 | -122.89 | 4 | 3 | 2 | 35 | 275.44 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.51 | 6.21 | -35.53 | 3 | 3 | 1 | 34 | 274.432 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.51 | 3.67 | -2.03 | 2 | 3 | 0 | 32 | 273.424 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.51 | 5.34 | -30.43 | 3 | 3 | 1 | 34 | 274.432 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.51 | 5.68 | -118.08 | 4 | 3 | 2 | 35 | 275.44 | 6 | ↓ |