In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 23 | Yes |
Popular Name: 1-amino-3-[(4-tert-butylbenzyl)(2-furylmethyl)amino]propan-2-ol 1-amino-3-[(4-tert-butylbenzyl)(…
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) | 2.26 | 4.31 | -46.32 | 4 | 4 | 1 | 64 | 317.453 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.26 | 3.68 | -5.48 | 3 | 4 | 0 | 63 | 316.445 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.26 | 6.02 | -34.23 | 4 | 4 | 1 | 64 | 317.453 | 8 | ↓ |