In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2008 | 21 | Yes |
Popular Name: (3S)-3-(aminomethyl)-1-benzyl-N,N-dipropyl-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) | 2.52 | 6.89 | -118.64 | 4 | 3 | 2 | 35 | 291.483 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.52 | 6.56 | -33.07 | 3 | 3 | 1 | 34 | 290.475 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.52 | 6.08 | -122.19 | 4 | 3 | 2 | 35 | 291.483 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.52 | 5.76 | -31.93 | 3 | 3 | 1 | 34 | 290.475 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.52 | 4.49 | -1.48 | 2 | 3 | 0 | 32 | 289.467 | 8 | ↓ |