In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: (3S)-3-(aminomethyl)-1-benzyl-N-cyclopropyl-N-methyl-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) | 1.13 | 5.52 | -125.02 | 4 | 3 | 2 | 35 | 261.413 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.13 | 5.2 | -31.43 | 3 | 3 | 1 | 34 | 260.405 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.13 | 3.19 | -45.38 | 3 | 3 | 1 | 34 | 260.405 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.13 | 2.49 | -2.07 | 2 | 3 | 0 | 32 | 259.397 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.13 | 5.22 | -121.39 | 4 | 3 | 2 | 35 | 261.413 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.13 | 5.17 | -28.2 | 3 | 3 | 1 | 34 | 260.405 | 5 | ↓ |