In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 23 | Yes |
Popular Name: 1-[(2S)-1-ethylpyrrolidin-2-yl]-N,N-bis(3-pyridylmethyl)methanamine 1-[(2S)-1-ethylpyrrolidin-2-yl]-…
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) | 1.46 | 9.21 | -39.7 | 1 | 4 | 1 | 33 | 311.453 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.46 | 6.95 | -4.82 | 0 | 4 | 0 | 32 | 310.445 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.46 | 8.4 | -34.26 | 1 | 4 | 1 | 33 | 311.453 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.46 | 8.85 | -89.78 | 2 | 4 | 2 | 35 | 312.461 | 7 | ↓ |